SCHEMBL2565529

SCHEMBL2565529

O=C(Cl)c1cc(Cl)c(Cl)nc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
SLC9A1 P19634 2/20 0.34
ALDH1A1 P00352 5/20 0.33
MAOB P27338 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
MAPK1 P28482 1/20 0.31
LMNA P02545 2/20 0.31
ALOX15 P16050 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
SORT1 Q99523 1/20 0.30
DAO P14920 2/20 0.30
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30
CASP1 P29466 1/20 0.30
S1PR2 O95136 1/20 0.30

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
SCHEMBL31153184 1.00 KEAP1 (0.44) KEAP1NFE2L2SLC9A1ALDH1A1MAOB
SCHEMBL2566963 0.82 KEAP1 (0.64) KEAP1NFE2L2ALDH1A1SMN1; SMN2MAPK1
SCHEMBL29406550 0.82 KEAP1 (0.64) KEAP1NFE2L2ALDH1A1SMN1; SMN2MAPK1
SCHEMBL29406095 0.80 CASP1 (0.47) KEAP1NFE2L2SLC9A1ALDH1A1LMNA
SCHEMBL25944824 0.80 SMN1; SMN2 (0.45) KEAP1NFE2L2SLC9A1ALDH1A1MAOB
SCHEMBL10873823 0.80 KEAP1 (0.62) KEAP1NFE2L2ALDH1A1SMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL10552257 0.80 KEAP1 (0.62) KEAP1NFE2L2ALDH1A1SMN1; SMN2MAPK1
SCHEMBL566114 0.80 CASP1 (0.47) KEAP1NFE2L2SLC9A1ALDH1A1LMNA
SCHEMBL919984 0.78 KEAP1 (0.71) KEAP1NFE2L2ALDH1A1MAOBALOX15
SCHEMBL31048928 0.78 KEAP1 (0.71) KEAP1NFE2L2ALDH1A1MAOBALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0187376-A2 6,7-Disubstituted 1-cyclopropyl-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acids BAYER AG (DE) 1986-07-16 EP claimed
US-12583854-B2 KRAS G12C inhibitors and methods of using the same AMGEN INC. (US) 2026-03-24 US disclosed
US-12195473-B2 KRAS mutant protein inhibitors JACOBIO PHARMACEUTICALS CO., LTD (CN) 2025-01-14 US disclosed
EP-4466258-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2024-11-27 EP disclosed
US-20240383875-A1 Benzimidazole Pyridine Derivatives HOFFMANN-LA ROCHE INC. (US) 2024-11-21 US disclosed
CN-116143804-B Tetracyclic quinolone compound, pharmaceutically acceptable salt and application thereof 核新生物医药(长春)有限公司 2024-03-29 CN disclosed
CN-115192577-B KRAS mutein inhibitors 北京加科思新药研发有限公司 2024-03-29 CN disclosed
CN-113286794-B KRAS mutein inhibitors 北京加科思新药研发有限公司 2024-03-12 CN disclosed
CN-117295742-A New forms of compound I and their use 北京加科思新药研发有限公司 2023-12-26 CN disclosed
US-20230357233-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-11-09 US disclosed
EP-2383268-A1 Pyrazolylaminopyridine derivatives useful as kinase inhibitors AstraZeneca AB (SE) 2011-11-02 EP disclosed
US-20080139561-A1 e.g. 6-(5-Cyclopropyl-1H-pyrazol-3-ylamino)-5-fluoro-2-(1-(4-fluorophenyl)ethylamino) nicotinonitrile; tropomyosin-related kinases (Trk's) inhibitor; anticarcinogenic agent; hormone related cancer, leukemia; antiinflammatory agent; arthritis, restenosis; autoimmune diseases ASTRAZENECA AB (SE) 2008-06-12 US disclosed
EP-1846394-A1 PYRAZOLYLAMINOPYRIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS AstraZeneca AB (SE) 2007-10-24 EP disclosed
WO-2006082392-A1 PYRAZOLYLAMINOPYRIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS ASTRAZENECA AB (SE) 2006-08-10 WO disclosed
US-RE32975-E FUNGICIDES, BACTERICIDES, FEED ADDITIVES BAYER AKTIENGESELLSCHAFT (DE) 1989-07-04 US disclosed
US-4840954-A BACTERICIDE BAYER AKTIENGESELLSCHAFT (DE) 1989-06-20 US disclosed
EP-0004279-B1 PROCESS FOR THE PREPARATION OF 4-PYRIDONE-3-CARBOXYLIC ACIDS, 1-CYCLOPROPYL-4-PYRIDONE-3-CARBOXYLIC ACID DERIVATIVES AND MEDICINES CONTAINING THEM BAYER AG (DE) 1982-12-29 EP disclosed
US-4284629-A ANIMAL GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1981-08-18 US disclosed
EP-0004279-A1 Process for the preparation of 4-pyridone-3-carboxylic acids, 1-cyclopropyl-4-pyridone-3-carboxylic acid derivatives and medicines containing them BAYER AG (DE) 1979-10-03 EP disclosed
US-4089960-A Antiemetic, psychosomatic and antipsychotic heterocyclic pyridine carboxamides CIBA-GEIGY CORPORATION (US) 1978-05-16 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 (5 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-20080139561-A1 e.g. 6-(5-Cyclopropyl-1H-pyrazol-3-ylamino)-5-fluoro-2-(1-(4-fluorophenyl)ethylamino) nicotinonitrile; tropomyosin-related kinases (Trk's) inhibitor; anticarcinogenic agent; hormone related cancer, leukemia; antiinflammatory agent; arthritis, restenosis; autoimmune diseases CNKSR1, LTK, MUSK KEAP1 2331/4885NFE2L2 2337/4885SLC9A1 4139/4885
US-12195473-B2 KRAS mutant protein inhibitors KRAS, NRAS, APC KEAP1 306/4885NFE2L2 3066/4885SLC9A1 4226/4885
US-20240383875-A1 Benzimidazole Pyridine Derivatives H1-3, H1-2, H1-4 KEAP1 2531/4885NFE2L2 1120/4885SLC9A1 2781/4885
US-12583854-B2 KRAS G12C inhibitors and methods of using the same KRAS, NRAS, APC KEAP1 688/4885NFE2L2 1284/4885SLC9A1 200/4885
US-20230357233-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF KRAS, NRAS, HRAS KEAP1 549/4885NFE2L2 1011/4885SLC9A1 2529/4885

“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.