SCHEMBL841648

SCHEMBL841648

CCCN(CCC)CCC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HRH3 Q9Y5N1 1/20 0.31
HTR1A P08908 1/20 0.30
DRD2 P14416 1/20 0.30
DRD3 P35462 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
SCHEMBL841608 1.00 TSHR (0.32) TSHRTDP1HRH3HTR1ADRD2
SCHEMBL10174210 0.90 FDPS (0.33)
SCHEMBL866725 0.89 KCNH2 (0.31)
SCHEMBL12669645 0.88 CYP1A2 (0.33) TSHR
SCHEMBL3217467 0.87 TSHR (0.31) TSHRTDP1
SCHEMBL20202518 0.84
SCHEMBL23192224 0.84 ALDH1A1 (0.33)
SCHEMBL12454224 0.84 FDPS (0.33)
SCHEMBL13293940 0.83 FDPS (0.31)
SCHEMBL25018206 0.83 CA12 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240229026-A1 CHIRAL CONTROL WAVE LIFE SCIENCES LTD. (SG) 2024-07-11 US disclosed
US-20230295617-A1 METHODS AND COMPOSITIONS OF BIOLOGICALLY ACTIVE AGENTS WAVE LIFE SCIENCES LTD. (SG) 2023-09-21 US disclosed
US-RE49594-E1 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2023-08-01 US disclosed
US-RE49594-E1 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2023-08-01 US disclosed
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors AJAX THERAPEUTICS, INC. (US) 2023-07-04 US disclosed
US-11643657-B2 Chiral control WAVE LIFE SCIENCES LTD. (SG) 2023-05-09 US disclosed
US-11535630-B2 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2022-12-27 US disclosed
WO-2022119645-A1 TREATED ARTICLE, METHODS OF MAKING THE TREATED ARTICLE, AND DISPERSION FOR USE IN MAKING THE TREATED ARTICLE AGC CHEMICALS AMERICAS, INC. (US) 2022-06-09 WO disclosed
WO-2022119644-A1 TREATED ARTICLE, METHODS OF MAKING THE TREATED ARTICLE, AND DISPERSION FOR USE IN MAKING THE TREATED ARTICLE AGC CHEMICALS AMERICAS, INC. (US) 2022-06-09 WO disclosed
US-11224601-B1 Compounds that inhibits MCL-1 protein AMGEN INC. (US) 2022-01-18 US disclosed
US-7642361-B2 Thiophene and furan compounds ELI LILLY AND COMPANY (US) 2010-01-05 US disclosed
US-7625932-B2 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-12-01 US disclosed
US-7601738-B2 Excitatory amino acid receptor antagonists ELI LILLY AND COMPANY (US) 2009-10-13 US disclosed
US-20090048300-A1 Heterocyclic Compounds S*BIO PTE LTD. (SG) 2009-02-19 US disclosed
US-20090048300-A1 Heterocyclic Compounds S*BIO PTE LTD. (SG) 2009-02-19 US disclosed
US-7247644-B2 Ester derivatives of a decahydroisoquinoline-3-carboxylic acid as analgestics ELI LILLY AND COMPANY (US) 2007-07-24 US disclosed
US-20070105852-A1 Thiophene and furan compounds ELI LILLY AND COMPANY 2007-05-10 US disclosed
US-7205313-B2 Excitatory amino acid receptor antagonists ELI LILLY AND COMPANY (US) 2007-04-17 US disclosed
US-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY 2007-03-22 US disclosed
US-7157582-B2 Selective iGluR5 receptor antagonists ELI LILLY AND COMPANY (US) 2007-01-02 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 (9 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-11535630-B2 Apelin receptor (APJ) agonists and uses thereof APLNR, AP1G1, APMAP TSHR 169/4885TDP1 4073/4885HRH3 1113/4885
US-20090048300-A1 Heterocyclic Compounds HDAC1, HDAC3, HDAC11 TSHR 3681/4885TDP1 649/4885HRH3 222/4885
US-20240229026-A1 CHIRAL CONTROL RNGTT, POLI, NSUN3 TSHR 3259/4885TDP1 924/4885HRH3 4581/4885
US-20230295617-A1 METHODS AND COMPOSITIONS OF BIOLOGICALLY ACTIVE AGENTS ELOVL6, ELOVL5, ELOVL1 TSHR 3764/4885TDP1 1846/4885HRH3 4845/4885
US-11643657-B2 Chiral control RNGTT, POLI, NSUN3 TSHR 3259/4885TDP1 924/4885HRH3 4581/4885
US-20070105852-A1 Thiophene and furan compounds PSEN2, PSEN1, TPMT TSHR 980/4885TDP1 287/4885HRH3 2934/4885
US-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors GRIN1, GRIN3A, GRIK5 TSHR 315/4885TDP1 1306/4885HRH3 1043/4885
US-11691963-B2 6-heteroaryloxy benzimidazoles and azabenzimidazoles as JAK2 inhibitors JAK2, JAK3, STAT5B TSHR 1333/4885TDP1 3813/4885HRH3 2355/4885
US-11224601-B1 Compounds that inhibits MCL-1 protein MCL1, BCL9, BCL2L1 TSHR 4716/4885TDP1 2735/4885HRH3 4697/4885

“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.