SCHEMBL1813129

SCHEMBL1813129

N#Cc1cccc(Cl)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.44
GRIA1 P42261 1/20 0.38
CACNG8 Q8WXS5 1/20 0.38
TSHR P16473 1/20 0.38
AR P10275 2/20 0.38
TRPV4 Q9HBA0 1/20 0.38
CYP11B2 P19099 2/20 0.37
NOTUM Q6P988 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ADORA2A P29274 1/20 0.35
PSMB8 P28062 4/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 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
SCHEMBL29741728 1.00 DYRK1A (0.44) DYRK1AGRIA1CACNG8TSHRAR
SCHEMBL24084247 0.88 ADORA2A (0.43) DYRK1AARCYP11B2CA1CA2
SCHEMBL1533157 0.83 TSHR (0.46) TSHRTRPV4NOTUMCA1CA2
SCHEMBL16958919 0.79 CYP1A2 (0.36) TSHRNOTUMALDH1A1MEN1GAA
SCHEMBL9845641 0.79 TRPV4 (0.43) DYRK1AARTRPV4CYP11B2KDM4E
SCHEMBL15540429 0.79 CYP1A2 (0.36) TSHRALDH1A1MEN1GAAKMT2A
SCHEMBL22316495 0.78 ADORA2A (0.40) DYRK1ATSHRARCYP11B2ADORA2A
SCHEMBL24084232 0.78 BCAT1 (0.41) DYRK1AGRIA1CACNG8ARCYP11B2
SCHEMBL16954084 0.77 TSHR (0.38) DYRK1AGRIA1CACNG8TSHRTRPV4
SCHEMBL15541355 0.77 CYP1A2 (0.35) TSHRNOTUMALDH1A1MEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3997096-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2024-08-28 EP claimed
CN-110302733-A Preparation method of double-halogen nitrogen-containing heterocyclic compound 北京六合宁远科技有限公司 2019-10-08 CN claimed
CN-109293503-A A kind of preparation method of the fluoro- 3- chlorobenzoic acid of 2,4,5- tri- 浙江工业大学上虞研究院有限公司 2019-02-01 CN claimed
CN-106279086-B Ganoderma lucidum furans A and its pharmaceutical composition and its application in pharmacy and food 中国科学院昆明植物研究所 2018-03-06 CN claimed
CN-106279086-A Ganoderma furan A and pharmaceutical composition thereof and its application in pharmacy and food 中国科学院昆明植物研究所 2017-01-04 CN claimed
EP-0073372-B1 PROCESS FOR PRODUCING 2,6-DIFLUOROBENZONITRILE ISHIHARA SANGYO KAISHA, LTD. (JP) 1984-08-01 EP claimed
US-4406841-A HYDROGENATION OF 3-CHLORO- (OR 3,5-DICHLORO-2,6-DIFLUOROBENZONITRILE, PALLADIUM OR PLATINUM CATALYST ISHIHARA SANGYO KAISHA LTD. (JP) 1983-09-27 US claimed
EP-0073372-A1 Process for producing 2,6-difluorobenzonitrile ISHIHARA SANGYO KAISHA, LTD. (JP) 1983-03-09 EP claimed
JP-1294653-A None JP disclosed
JP-1311052-A None JP disclosed
US-12570799-B2 Crystalline polyethernitrile TORAY INDUSTRIES, INC. (JP) 2026-03-10 US disclosed
EP-4680333-A1 PHENYLPIPERIDINE DERIVATIVES AS INHIBITORS OF GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE AND GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE LIKE PROTEIN Boehringer Ingelheim International GmbH (DE) 2026-01-21 EP disclosed
US-20250304576-A1 IKK INHIBITORS CANCER RESEARCH TECH LTD (GB) 2025-10-02 US disclosed
US-20250243183-A1 IMIDAZOLYL PYRIMIDINYLAMINE COMPOUNDS AS CDK2 INHIBITORS INCYTE CORPORATION 2025-07-31 US disclosed
US-4406841-A HYDROGENATION OF 3-CHLORO- (OR 3,5-DICHLORO-2,6-DIFLUOROBENZONITRILE, PALLADIUM OR PLATINUM CATALYST ISHIHARA SANGYO KAISHA LTD. (JP) 1983-09-27 US disclosed
US-4406841-A HYDROGENATION OF 3-CHLORO- (OR 3,5-DICHLORO-2,6-DIFLUOROBENZONITRILE, PALLADIUM OR PLATINUM CATALYST ISHIHARA SANGYO KAISHA LTD. (JP) 1983-09-27 US disclosed
EP-0073372-A1 Process for producing 2,6-difluorobenzonitrile ISHIHARA SANGYO KAISHA, LTD. (JP) 1983-03-09 EP disclosed
EP-0073372-A1 Process for producing 2,6-difluorobenzonitrile ISHIHARA SANGYO KAISHA, LTD. (JP) 1983-03-09 EP disclosed
US-4351777-A Preparation of fluorobenzonitriles RHONE-POULENC INDUSTRIES (FR) 1982-09-28 US disclosed
US-4209457-A Production of halogenated benzonitriles I.S. C. Chemicals Limited (GB) 1980-06-24 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-20250304576-A1 IKK INHIBITORS NFKBIA, IKBKE, IKBKB DYRK1A 707/4885GRIA1 2707/4885CACNG8 4046/4885
US-12570799-B2 Crystalline polyethernitrile AR, NR5A1, ESRRA DYRK1A 4824/4885GRIA1 884/4885CACNG8 2700/4885
US-20250243183-A1 IMIDAZOLYL PYRIMIDINYLAMINE COMPOUNDS AS CDK2 INHIBITORS CDK2, CDK4, CDK2AP2 DYRK1A 1027/4885GRIA1 3172/4885CACNG8 4461/4885

“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.