SCHEMBL10028024

SCHEMBL10028024

CC(C)(C)SCCC(=O)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 0.37
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 2/20 0.31
HPGD P15428 3/20 0.31
HSP90AA1 P07900 1/20 0.30
KMT2A Q03164 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25748607 0.87 LMNA (0.36) HTR1ADRD2HTR2AHTR7NPC1
SCHEMBL16938128 0.86 SMN1; SMN2 (0.35) HTR1ADRD2HTR2AHTR7NPC1
SCHEMBL16722812 0.79 KMT2A (0.46) SMN1; SMN2ALDH1A1HPGDKMT2A
SCHEMBL17123489 0.79 TSHR (0.48) KMT2A
SCHEMBL12391964 0.79 HTR1A (0.30) HTR1ADRD2HTR2AHTR7NPC1
SCHEMBL12659419 0.78 RECQL (0.37) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL15961517 0.77 ALDH1A1 (0.45) HTR1ADRD2HTR2AHTR7NPC1
SCHEMBL8608901 0.77 TSHR (0.52) HTR1ADRD2HTR2AHTR7NPC1
SCHEMBL13610829 0.77 FOLH1 (0.36) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL12750747 0.76 KDM4E (0.32) SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230364277-A1 E-SELECTIN TARGETING AGENTS GLYCOMIMETICS, INC. (US) 2023-11-16 US disclosed
US-20230167150-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS GLYCOMIMETICS, INC. (US) 2023-06-01 US disclosed
US-20230167149-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS GLYCOMIMETICS, INC. (US) 2023-06-01 US disclosed
US-20230144534-A1 CLEAVABLE TETRAZINE USED IN BIO-ORTHOGONAL DRUG ACTIVATION TAGWORKS PHARMACEUTICALS B.V. (NL) 2023-05-11 US disclosed
US-9907860-B2 Conjugated molecules comprising a peptide derived from the CD4 receptor coupled to an anionic polypeptide for the treatment of AIDS INSTITUT PASTEUR (FR) 2018-03-06 US disclosed
US-20170326246-A1 CONJUGATED MOLECULES COMPRISING A PEPTIDE DERIVED FROM THE CD4 RECEPTOR COUPLED TO AN ANIONIC POLYPEPTIDE FOR THE TREATMENT OF AIDS UNIVERSITÉ PARIS-SACLAY (FR) 2017-11-16 US disclosed
US-20170326246-A1 CONJUGATED MOLECULES COMPRISING A PEPTIDE DERIVED FROM THE CD4 RECEPTOR COUPLED TO AN ANIONIC POLYPEPTIDE FOR THE TREATMENT OF AIDS UNIVERSITÉ PARIS-SACLAY (FR) 2017-11-16 US disclosed
US-9295730-B2 Conjugated molecules comprising a peptide derived from the CD4 receptor coupled to a polyanion for the treatment of AIDS INSTITUT PASTEUR (FR) 2016-03-29 US disclosed
US-9295730-B2 Conjugated molecules comprising a peptide derived from the CD4 receptor coupled to a polyanion for the treatment of AIDS INSTITUT PASTEUR (FR) 2016-03-29 US disclosed
US-9078928-B2 Conjugated molecules comprising a peptide derived from the CD4 receptor coupled to a polyanionic polypeptide for the treatment of AIDS INSTITUT PASTEUR (FR) 2015-07-14 US disclosed
US-8110559-B2 Hindered ester-based biodegradable linkers for oligonucleotide delivery ENZON PHARMACEUTICALS, INC. (US) 2012-02-07 US disclosed
US-20110105412-A1 CONJUGATED MOLECULES COMPRISING A PEPTIDE DERIVED FROM THE CD4 RECEPTOR COUPLED TO A POLYANION FOR THE TREATMENT OF AIDS UNIVERSITE PARIS-SUD (FR) 2011-05-05 US disclosed
US-20100279408-A1 POLYMERIC SHORT INTERFERING RNA CONJUGATES ENZON PHARMACEUTICALS, INC. (US) 2010-11-04 US disclosed
US-20100234444-A1 HINDERED ESTER-BASED BIODEGRADABLE LINKERS FOR OLIGONUCLEOTIDE DELIVERY ENZON PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-20100233190-A1 TARGETED POLYMERIC PRODRUGS CONTAINING MULTIFUNCTIONAL LINKERS ENZON PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-20100233190-A1 TARGETED POLYMERIC PRODRUGS CONTAINING MULTIFUNCTIONAL LINKERS ENZON PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-20100203066-A1 POLYMERIC LINKERS CONTAINING PYRIDYL DISULFIDE MOIETIES ENZON PHARMACEUTICALS, INC. (US) 2010-08-12 US disclosed
US-20090232833-A1 POLYALKYLENE OXIDES HAVING HINDERED ESTER-BASED BIODEGRADABLE LINKERS ENZON PHARMACEUTICALS, INC. (US) 2009-09-17 US disclosed
US-20090202573-A1 POLYMERIC CONJUGATES CONTAINING POSITIVELY-CHARGED MOIETIES ENZON PHARMACEUTICALS, INC. (US) 2009-08-13 US disclosed
US-20090203706-A1 LYSINE-BASED POLYMERIC LINKERS ENZON PHARMACEUTICALS, INC. (US) 2009-08-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170326246-A1 CONJUGATED MOLECULES COMPRISING A PEPTIDE DERIVED FROM THE CD4 RECEPTOR COUPLED TO AN ANIONIC POLYPEPTIDE FOR THE TREATMENT OF AIDS CD4, CD40LG, HAVCR2 HTR1A 2511/4885DRD2 2154/4885HTR2A 3446/4885
US-20230167150-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS SIGLEC7, SIGLEC9, CD47 HTR1A 4197/4885DRD2 4618/4885HTR2A 4387/4885
US-20100233190-A1 TARGETED POLYMERIC PRODRUGS CONTAINING MULTIFUNCTIONAL LINKERS PAICS, FCGRT, DNPEP HTR1A 3755/4885DRD2 2044/4885HTR2A 3530/4885
US-20100279408-A1 POLYMERIC SHORT INTERFERING RNA CONJUGATES SNRPE, RNASE1, PHAX HTR1A 4626/4885DRD2 3528/4885HTR2A 4468/4885
US-20110105412-A1 CONJUGATED MOLECULES COMPRISING A PEPTIDE DERIVED FROM THE CD4 RECEPTOR COUPLED TO A POLYANION FOR THE TREATMENT OF AIDS CD4, CD40LG, CD40 HTR1A 3142/4885DRD2 2521/4885HTR2A 3903/4885
US-20090202573-A1 POLYMERIC CONJUGATES CONTAINING POSITIVELY-CHARGED MOIETIES PIGO, PHOSPHO1, PAICS HTR1A 3993/4885DRD2 2469/4885HTR2A 3594/4885
US-20230144534-A1 CLEAVABLE TETRAZINE USED IN BIO-ORTHOGONAL DRUG ACTIVATION KIT, TPSB2, BTD HTR1A 1323/4885DRD2 2913/4885HTR2A 1007/4885
US-20090232833-A1 POLYALKYLENE OXIDES HAVING HINDERED ESTER-BASED BIODEGRADABLE LINKERS CES2, PLOD3, FASN HTR1A 4319/4885DRD2 4126/4885HTR2A 3200/4885
US-20230167149-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS SIGLEC7, SIGLEC9, ASGR1 HTR1A 4386/4885DRD2 4554/4885HTR2A 4409/4885
US-20230364277-A1 E-SELECTIN TARGETING AGENTS SELE, SELPLG, SELP HTR1A 3473/4885DRD2 2728/4885HTR2A 3700/4885
US-20100203066-A1 POLYMERIC LINKERS CONTAINING PYRIDYL DISULFIDE MOIETIES P4HB, PRDX4, SCLY HTR1A 3368/4885DRD2 1762/4885HTR2A 3510/4885
US-20090203706-A1 LYSINE-BASED POLYMERIC LINKERS KARS1, JMJD6, PHYKPL HTR1A 3821/4885DRD2 2931/4885HTR2A 4084/4885
US-20100234444-A1 HINDERED ESTER-BASED BIODEGRADABLE LINKERS FOR OLIGONUCLEOTIDE DELIVERY VEGFA, DCLRE1B, MSN HTR1A 4658/4885DRD2 4364/4885HTR2A 4355/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.