SCHEMBL4885849

SCHEMBL4885849

CCCOc1c[c]ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.44
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 4/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
USP2 O75604 2/20 0.36
ALDH1A1 P00352 2/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
CASP1 P29466 1/20 0.36
HTT P42858 1/20 0.36
CASP7 P55210 1/20 0.36
ATM Q13315 1/20 0.36
PDE7A Q13946 1/20 0.35
PDE7B Q9NP56 1/20 0.35
L3MBTL1 Q9Y468 5/20 0.35
MCHR1 Q99705 1/20 0.35

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
SCHEMBL4888139 0.91 SMN1; SMN2 (0.42) CSNK2A1NPC1RAB9AMAPTALDH1A1
SCHEMBL27639456 0.89 MAPT (0.38) CSNK2A1NPC1RAB9AMAPTKMT2A
SCHEMBL161592 0.85 CSNK2A1 (0.47) CSNK2A1NPC1RAB9AMAPTKMT2A
SCHEMBL596640 0.85 L3MBTL1 (0.37) RAB9AMAPTKMT2AMEN1ALDH1A1
SCHEMBL4887608 0.84 L3MBTL1 (0.45) CSNK2A1NPC1RAB9AMAPTKMT2A
SCHEMBL4881875 0.84 L3MBTL1 (0.40) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL687572 0.82 MAPT (0.39) CSNK2A1MAPTKMT2AMEN1USP2
SCHEMBL16973600 0.82 L3MBTL1 (0.38) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL1691562 0.82 MCHR1 (0.40) NPC1RAB9AMAPTKMT2AMEN1
SCHEMBL28609134 0.81 HTR2C (0.38) NPC1RAB9AALDH1A1PDE7APDE7B

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
US-20230150931-A1 FABP4/5 INHIBITORS, METHODS OF USE AND METHODS OF MAKING NOVIUS THERAPEUTICS, LLC (US) 2023-05-18 US disclosed
CN-104411312-B The combination for being used in treatment neurological or dysbolism use including PDE2 the inhibitor such as methyl of 1 aryl 4 [1,2,4] triazole [4,3 A] quinoxaline compounds and PDE10 inhibitor 詹森药业有限公司 2018-03-06 CN disclosed
CN-107690281-A Cystic fibrosis transmembrane transduction modulator modulators 弗特克斯药品有限公司 2018-02-13 CN disclosed
CN-104411312-A Combinations comprising PDE 2 inhibitors such as 1-aryl-4-methyl- [1,2,4] triazolo [4,3-a] quinoxaline compounds and PDE 10 inhibitors for use in the treatment of neurological or metabolic disorders JANSSEN PHARMACEUTICA NV 2015-03-11 CN disclosed
US-20080293939-A1 QUINAZOLINONE DERIVATIVES USEFUL AS ANTI-HYPERALGESIC AGENTS CULSHAW ANDREW JAMES 2008-11-27 US disclosed
CN-100432059-C Quinazolinone derivatives useful as anti-hyperalgesic agents NOVARTIS AG (CH) 2008-11-12 CN disclosed
US-20060154942-A1 Quinazolinone derivatives useful as anti-hyperalgesic agents CULSHAW ANDREW J 2006-07-13 US disclosed
CN-1711249-A Quinazolinone derivatives useful as anti-hyperalgesic agents NOVARTIS AG (CH) 2005-12-21 CN disclosed
CN-1138762-C Phenylpyridazinones 2004-02-18 CN disclosed
US-20030119673-A1 Phenylpyridazinones LINKER KARL-HEINZ (DE) 2003-06-26 US disclosed
CN-1192208-A Phenylpyridazinones BAYER AG (DE) 1998-09-02 CN 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 (4 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-20080293939-A1 QUINAZOLINONE DERIVATIVES USEFUL AS ANTI-HYPERALGESIC AGENTS OPRK1, OPRL1, TRPV1 CSNK2A1 413/4885NPC1 3242/4885RAB9A 1166/4885
US-20030119673-A1 Phenylpyridazinones CYP2D6, CYP1A1, CYP1B1 CSNK2A1 2296/4885NPC1 4089/4885RAB9A 2247/4885
US-20230150931-A1 FABP4/5 INHIBITORS, METHODS OF USE AND METHODS OF MAKING FABP5, FABP1, FABP4 CSNK2A1 4398/4885NPC1 268/4885RAB9A 3995/4885
US-20060154942-A1 Quinazolinone derivatives useful as anti-hyperalgesic agents OPRK1, OPRL1, TRPV1 CSNK2A1 413/4885NPC1 3242/4885RAB9A 1166/4885

“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.