SCHEMBL2310035

SCHEMBL2310035

O=C(O)c1cc2cc(Cl)ccc2nc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
CYP2C9 P11712 2/20 0.50
PTGES O14684 1/20 0.50
ALOX5 P09917 1/20 0.50
HPGD P15428 1/20 0.50
CASP7 P55210 1/20 0.50
HIF1A Q16665 1/20 0.50
HSD17B10 Q99714 1/20 0.50
RXFP1 Q9HBX9 1/20 0.49
KDM4E B2RXH2 2/20 0.49
CYP1A2 P05177 1/20 0.49
GPR35 Q9HC97 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KEAP1 Q14145 1/20 0.49
NFE2L2 Q16236 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
CASP1 P29466 1/20 0.48
MEN1 O00255 2/20 0.47

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
SCHEMBL30682029 1.00 ALDH1A1 (0.50) ALDH1A1CYP2C9PTGESALOX5HPGD
SCHEMBL30681928 0.86 KEAP1 (0.49) ALDH1A1CYP2C9PTGESALOX5HPGD
SCHEMBL4497318 0.86 KEAP1 (0.49) ALDH1A1CYP2C9PTGESALOX5HPGD
SCHEMBL16945099 0.83 KMT2A (0.71) ALDH1A1HSD17B10KDM4EMEN1KMT2A
SCHEMBL26617507 0.83 KEAP1 (0.54) ALDH1A1ALOX5HPGDHSD17B10RXFP1
SCHEMBL2532082 0.83 KMT2A (0.71) ALDH1A1CYP2C9PTGESALOX5HPGD
SCHEMBL28234137 0.83 MEN1 (0.49) ALDH1A1CYP2C9PTGESALOX5HPGD
SCHEMBL790264 0.83 PRNP (0.53) ALDH1A1CYP2C9PTGESALOX5HPGD
SCHEMBL2314993 0.83 DHODH (0.48) ALDH1A1HPGDHSD17B10RXFP1KDM4E
SCHEMBL790477 0.81 PRNP (0.52) ALDH1A1CYP2C9PTGESALOX5HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4514789-A1 <SUP2/>? <SUB2/>?V?BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA1.8 FOR THE TREATMENT OF PAIN SiteOne Therapeutics, Inc. (US) 2025-03-05 EP disclosed
WO-2023211990-A1 BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA V1.8 FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS, INC. (US) 2023-11-02 WO disclosed
WO-2023211990-A1 BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA V1.8 FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS, INC. (US) 2023-11-02 WO disclosed
CN-103601674-B A kind of suppress dipeptides kininase compound and preparation method and purposes ZHEJIANG UNIVERSITY (CN) 2015-09-23 CN disclosed
CN-102532009-B compound for inhibiting dipeptide kininase and preparation method and application thereof UNIV ZHEJIANG 2014-11-05 CN disclosed
CN-103601674-A Compounds for inhibiting dipeptide kininase, preparation method and applications thereof UNIV ZHEJIANG 2014-02-26 CN disclosed
US-8288549-B2 Glycine B antagonist MERZ PHARMA GMBH & CO. KGAA (DE) 2012-10-16 US disclosed
CN-102532009-A Compound for inhibiting dipeptide kininase and preparation method and application thereof UNIV ZHEJIANG 2012-07-04 CN disclosed
US-20110190342-A1 GLYCINE B ANTAGONIST HENRICH MARKUS 2011-08-04 US disclosed
EP-2350014-A1 GLYCINE B ANTAGONISTS Merz Pharma GmbH & Co. KGaA (DE) 2011-08-03 EP disclosed
WO-2010037533-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO KGAA (DE) 2010-04-08 WO 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 (1 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-20110190342-A1 GLYCINE B ANTAGONIST GRIN2B, GLRB, GRIN2A ALDH1A1 4071/4885CYP2C9 2926/4885PTGES 1448/4885

“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.