SCHEMBL1880467

SCHEMBL1880467

Cc1ccc2cc(C=O)c(Cl)nc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 1.00
CYP1A2 P05177 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2D6 P10635 1/20 0.65
CYP2C19 P33261 1/20 0.65
KDM4E B2RXH2 3/20 0.62
GAA P10253 3/20 0.62
KMT2A Q03164 4/20 0.61
MAPT P10636 4/20 0.61
MEN1 O00255 3/20 0.61
MPI P34949 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
PABPC1 P11940 1/20 0.60
NPSR1 Q6W5P4 1/20 0.54
KDR P35968 8/20 0.53
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
THRB P10828 1/20 0.51

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
SCHEMBL30908496 1.00 ALDH1A1 (1.00) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL1880623 0.88 ALDH1A1 (0.78) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL31345649 0.82 ALDH1A1 (0.70) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL4488260 0.82 ALDH1A1 (0.70) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL32662668 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL29862350 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL6509 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL378904 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL22982789 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL15941760 0.79 ALDH1A1 (0.66) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119585247-A Bicyclic heterocyclic amide inhibitors of nav1.8 for the treatment of pain 赛特温治疗公司 2025-03-07 CN disclosed
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-2024074611-A1 PRMT5 INHIBITORS Ryvu Therapeutics S.A. (PL) 2024-04-11 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
WO-2023138599-A1 AROMATIC FUSED RING NAV1.8 INHIBITOR, AND USE THEREOF 成都康弘药业集团股份有限公司 2023-07-27 WO disclosed
CN-116462662-A Aromatic ring Nav1.8 inhibitor and application thereof 成都康弘药业集团股份有限公司 2023-07-21 CN disclosed
US-11685738-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof OCUTERRA THERAPEUTICS, INC. (US) 2023-06-27 US disclosed
EP-3259271-B1 FLUORINATED DERIVATIVES OF 3-(2-OXO-3-(3-(5,6,7,8-TETRAHYDRO-1,8-NAPHTHYRIDIN-2-YL)PROPYL)IMIDAZOLIDIN-1-YL)PROPANOIC ACID AND USES THEREOF SCIFLUOR LIFE SCIENCES INC (US) 2021-05-05 EP disclosed
EP-3674301-A1 FLUORINATED INTEGRIN ANTAGONISTS SciFluor Life Sciences, Inc. (US) 2020-07-01 EP disclosed
EP-3266782-B1 FLUORINATED INTEGRIN ANTAGONISTS SCIFLUOR LIFE SCIENCES INC (US) 2019-10-30 EP disclosed
US-20050043352-A1 Quinoline inhibitors of hyaki and hyak3 kinases SMITHKLINE BEECHAM CORPORATION 2005-02-24 US disclosed
EP-1372654-A2 QUINOLINE INHIBITORS OF HYAK1 AND HYAK3 KINASES SmithKline Beecham Corporation (US) 2004-01-02 EP disclosed
WO-2002081728-A2 QUINOLINE INHIBITORS OF HYAK1 AND HYAK3 KINASES SMITHKLINE BEECHAM CORPORATION (US) 2002-10-17 WO disclosed
EP-0858444-A4 CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO INC (US) 1999-12-01 EP disclosed
EP-0858444-A1 CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 1998-08-19 EP disclosed
US-5750549-A ANTIINFLAMMATORY AGENTS OR ANALGESICS MERCK & CO., INC. (US) 1998-05-12 US disclosed
US-5710139-A Heterocyclic compounds ASTRA AB (SE) 1998-01-20 US disclosed
WO-1997014671-A1 CYCLOPENTYL TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1997-04-24 WO disclosed
EP-0736032-A1 HETEROCYCLIC COMPOUNDS Astra Aktiebolag (SE) 1996-10-09 EP disclosed
WO-1995017410-A1 HETEROCYCLIC COMPOUNDS ASTRA AKTIEBOLAG (SE) 1995-06-29 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 (2 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-20050043352-A1 Quinoline inhibitors of hyaki and hyak3 kinases HIPK3, HIPK1, HYPK ALDH1A1 3983/4885CYP1A2 3658/4885CYP3A4 4511/4885
US-11685738-B2 Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof FFAR3, FFAR2, FFAR1 ALDH1A1 1949/4885CYP1A2 2338/4885CYP3A4 1876/4885

“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.