SCHEMBL120463

SCHEMBL120463

O=Cc1cc2cc(Cl)ccc2o1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.62
MAOB P27338 4/20 0.55
APP P05067 1/20 0.51
KDM4E B2RXH2 5/20 0.47
GPR35 Q9HC97 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
KMT2A Q03164 1/20 0.46
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
HSD17B10 Q99714 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TSHR P16473 1/20 0.41
ALOX5 P09917 1/20 0.41

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
Trifluoroacetic Acid SCHEMBL28666970 0.86 CYP2A6 (0.49) CYP2A6MAOBAPPKDM4EGPR35
SCHEMBL24045462 0.85 CYP2A6 (0.58) CYP2A6MAOBAPPCA12CA9
SCHEMBL8038932 0.82 APP (0.54) CYP2A6MAOBAPPKDM4EGPR35
SCHEMBL8038933 0.82 APP (0.54) CYP2A6MAOBAPPKDM4EGPR35
SCHEMBL8784045 0.79 CYP2A6 (0.44) CYP2A6MAOBAPPKDM4EALDH1A1
SCHEMBL5144216 0.78 CYP2A6 (0.65) CYP2A6APP
SCHEMBL11403521 0.77 CYP2A6 (0.62) CYP2A6MAOBAPPKDM4EALDH1A1
SCHEMBL10047130 0.77 CYP2A6 (0.62) CYP2A6APP
SCHEMBL12227345 0.77 CYP2A6 (0.62) CYP2A6MAOBAPPKDM4EALDH1A1
SCHEMBL118925 0.77 CYP2A6 (0.62) CYP2A6APPKDM4EALDH1A1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110078720-B Halogenated benzofuran-coumarin derivative and application thereof in preparation of anti-fouling agent 扬州工业职业技术学院 2020-07-17 CN claimed
CN-110078720-A Halogenated benzofuran-coumarin derivative and its preparing the application in fouling resistance agent 扬州工业职业技术学院 2019-08-02 CN claimed
EP-4691558-A2 TREATMENT OR PROPHYLAXIS OF PROLIFERATIVE CONDITIONS University Court of The University of Dundee (GB) 2026-02-11 EP disclosed
US-20250295789-A1 TREATMENT OR PROPHYLAXIS OF PROLIFERATIVE CONDITIONS UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2025-09-25 US disclosed
EP-2857018-B1 Treatment or prophylaxis of proliferative conditions UNIV COURT OF THE UNIV OF DUNDEE (GB) 2025-09-03 EP disclosed
CN-116768877-A ISR inhibitor and preparation method and application thereof 中国药科大学 2023-09-19 CN disclosed
EP-3177601-B1 TLR-INDEPENDENT SMALL MOLECULE ADJUVANTS SCRIPPS RESEARCH INST (US) 2023-03-01 EP disclosed
US-20220031852-A1 TREATMENT OR PROPHYLAXIS OF PROLIFERATIVE CONDITIONS UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2022-02-03 US disclosed
US-20220031852-A1 TREATMENT OR PROPHYLAXIS OF PROLIFERATIVE CONDITIONS UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2022-02-03 US disclosed
WO-2021195603-A1 ANTI-MALARIAL COMPOUNDS AND USES THEREOF VIRGINIA POLYTECHNIC INSTITUTE AND STATE UNIVERSITY (US) 2021-09-30 WO disclosed
US-20200360521-A1 TREATMENT OR PROPHYLAXIS OF PROLIFERATIVE CONDITIONS UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2020-11-19 US disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO disclosed
US-6025390-A Heteroaromatic pentadienoic acid derivatives useful as inhibitors of bone resorption SMITHKLINE BEECHAM SPA (IT) 2000-02-15 US disclosed
EP-0912539-A1 HETEROAROMATIC PENTADIENOIC ACID DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION Smithkline Beecham S.p.A. (IT) 1999-05-06 EP disclosed
WO-1998001436-A1 HETEROAROMATIC PENTADIENOIC ACID DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION SMITHKLINE BEECHAM S.P.A. (IT) 1998-01-15 WO disclosed
EP-0029320-B1 SECONDARY ETHANOL AMINES, THEIR PREPARATION AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1985-07-10 EP disclosed
US-4341793-A HYPOGLYCEMIC AGENTS AND DIETETICS BEECHAM GROUP LIMITED (GB) 1982-07-27 US disclosed
EP-0029320-A2 Secondary ethanol amines, their preparation and their use in pharmaceutical compositions BEECHAM GROUP PLC (GB) 1981-05-27 EP disclosed
US-4006234-A Substituted 2-benzofuranyl propenones as anti-tubercular agents AMERICAN CYANAMID COMPANY (US) 1977-02-01 US disclosed
US-3931157-A ANTITUBERCULAR AMERICAN CYANAMID COMPANY (US) 1976-01-06 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 (3 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-20200360521-A1 TREATMENT OR PROPHYLAXIS OF PROLIFERATIVE CONDITIONS CYP1B1, UGT1A1, CYP1A1 CYP2A6 62/4885MAOB 210/4885APP 3238/4885
US-20220031852-A1 TREATMENT OR PROPHYLAXIS OF PROLIFERATIVE CONDITIONS CYP1B1, UGT1A1, CYP1A1 CYP2A6 62/4885MAOB 210/4885APP 3238/4885
US-20250295789-A1 TREATMENT OR PROPHYLAXIS OF PROLIFERATIVE CONDITIONS CYP1B1, BRCA1, UGT1A1 CYP2A6 81/4885MAOB 236/4885APP 3745/4885

“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.