SCHEMBL464425

SCHEMBL464425

CC(C)C(=O)Sc1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HSD17B10 Q99714 2/20 0.49
EHMT2 Q96KQ7 1/20 0.47
EHMT1 Q9H9B1 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
ALDH1A1 P00352 8/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
RAB9A P51151 2/20 0.43
TSHR P16473 1/20 0.43
NPC1 O15118 1/20 0.43
ALOX15 P16050 1/20 0.43
HTT P42858 1/20 0.42
MDM4 O15151 1/20 0.42
TP53 P04637 1/20 0.42
MDM2 Q00987 1/20 0.42

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
SCHEMBL4757038 0.79 EHMT2 (0.52) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL5262431 0.78 ALDH1A1 (0.48) HPGDSMN1; SMN2HSD17B10ALDH1A1LMNA
SCHEMBL5633792 0.78 EHMT2 (0.56) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL3075428 0.78 EHMT2 (0.56) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL12786631 0.77 SMN1; SMN2 (0.43) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL1479297 0.76 ALDH1A1 (0.55) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL7102145 0.75 HPGD (0.42) HPGDSMN1; SMN2HSD17B10ALDH1A1LMNA
SCHEMBL3070731 0.75 EHMT2 (0.52) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL3125142 0.75 EHMT2 (0.52) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1
SCHEMBL1607377 0.74 LMNA (0.51) HPGDSMN1; SMN2HSD17B10EHMT2EHMT1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11638760-B2 Pyrrolobenzodiazepine antibody conjugates MERSANA THERAPEUTICS, INC. (US) 2023-05-02 US disclosed
US-9808528-B2 Protein-polymer-drug conjugates and methods of using same MERSANA THERAPEUTICS, INC. (US) 2017-11-07 US disclosed
US-9770519-B2 Protein-polymer-drug conjugates MERSANA THERAPEUTICS, INC. (US) 2017-09-26 US disclosed
US-8329876-B2 Thioester-terminated water soluble polymers and method of modifying the N-terminus of a polypeptide therewith NEKTAR THERAPEUTICS (US) 2012-12-11 US disclosed
US-8288351-B2 Antagonists of the bradykinin B1 receptor AMGEN INC. (US) 2012-10-16 US disclosed
US-20120065330-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith NEKTAR THERAPEUTICS (US) 2012-03-15 US disclosed
US-8071678-B2 Thioester-terminated water soluble polymers and method of modifying the N-terminus of a polypeptide therewith NEKTAR THERAPEUTICS (US) 2011-12-06 US disclosed
US-20110065862-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith NEKTAR THERAPEUTICS (US) 2011-03-17 US disclosed
US-7834088-B2 Thioester-terminated water soluble polymers and method of modifying the N-terminus of a polypeptide therewith NEKTAR THERAPEUTICS (US) 2010-11-16 US disclosed
US-20100069571-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith NEKTAR THERAPEUTICS (US) 2010-03-18 US disclosed
US-7605120-B2 peptides and/or conjugated peptides may be used as therapeutics or prophylactics for the treatment of diseases mediated by B1 activation, including inflammation and chronic pain states of inflammatory and neuropathic origin, septic shock, arthritis, osteoarthritis, angina, asthma, allergic rhinitis AMGEN INC. (US) 2009-10-20 US disclosed
US-20090137483-A1 Antagonists of the bradykinin B1 receptor AMGEN INC. 2009-05-28 US disclosed
US-7511095-B2 Thioester-terminated water soluble polymers and method of modifying the N-terminus of a polypeptide therewith NEKTAR THERAPEUTICS AL, CORPORATION (US) 2009-03-31 US disclosed
US-20090048149-A1 Antagonists of the bradykinin B1 receptor AMGEN INC. 2009-02-19 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 (5 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-20090048149-A1 Antagonists of the bradykinin B1 receptor BDKRB1, BDKRB2, LTB4R HPGD 1147/4885SMN1; SMN2 3387/4885HSD17B10 4301/4885
US-20100069571-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith PCTP, CETP, NGLY1 HPGD 1334/4885SMN1; SMN2 4702/4885HSD17B10 1049/4885
US-20090137483-A1 Antagonists of the bradykinin B1 receptor BDKRB1, BDKRB2, AVPR1B HPGD 944/4885SMN1; SMN2 3416/4885HSD17B10 4290/4885
US-11638760-B2 Pyrrolobenzodiazepine antibody conjugates GABRA4, GABRA1, GABRA2 HPGD 1806/4885SMN1; SMN2 2695/4885HSD17B10 1974/4885
US-20120065330-A1 Thioester-Terminated Water Soluble Polymers and Method of Modifying the N-Terminus of a Polypeptide Therewith PCTP, CETP, NGLY1 HPGD 1334/4885SMN1; SMN2 4702/4885HSD17B10 1049/4885

“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.