SCHEMBL4763456

SCHEMBL4763456

Cc1nn(C)c(C(=O)O)c1C

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
POLB P06746 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 5/20 0.40
GAA P10253 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.38
APAF1 O14727 1/20 0.35
USP2 O75604 1/20 0.34
LMNA P02545 3/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HTT P42858 1/20 0.34
GALR3 O60755 1/20 0.34
NR2F2 P24468 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL18382968 0.82 KDM4E (0.43) L3MBTL1KDM4EALDH1A1GAASMN1; SMN2
SCHEMBL29291582 0.82 GAA (0.40) MAPTL3MBTL1POLBTDP1KDM4E
SCHEMBL3056019 0.80 KDM4E (0.46) MAPTL3MBTL1KDM4EALDH1A1GAA
SCHEMBL4350886 0.80 KDM4E (0.45) MAPTL3MBTL1POLBTDP1KDM4E
SCHEMBL1889853 0.80 L3MBTL1 (0.43) MAPTL3MBTL1POLBTDP1KDM4E
SCHEMBL4166587 0.80 KDM4E (0.46) L3MBTL1KDM4EALDH1A1GAASMN1; SMN2
SCHEMBL2363096 0.80 L3MBTL1 (0.43) MAPTL3MBTL1POLBTDP1KDM4E
SCHEMBL3138514 0.80 POLB (0.43) MAPTL3MBTL1POLBTDP1KDM4E
SCHEMBL19556155 0.78 L3MBTL1 (0.42) MAPTL3MBTL1POLBTDP1KDM4E
SCHEMBL2373838 0.78 KDM4E (0.62) MAPTL3MBTL1POLBTDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116768795-A Synthesis method of cyenopyrafen intermediate 湖南速博生物技术有限公司 2023-09-19 CN claimed
CN-107216288-A A kind of preparation method of Tolfenpyrad impurity 湖南大学 2017-09-29 CN claimed
WO-2025049827-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING PYRAZOLE DERIVATIVES OSMO LABS, PBC (US) 2025-03-06 WO disclosed
WO-2025022637-A1 METHOD FOR PRODUCING CYCLIZED PRODUCT BY CYCLIZATION REACTION INVOLVING DEHYDRATION CONDENSATION OF CARBOXYLIC ACID ESTER DERIVATIVE, AND METHOD FOR PRODUCING 1,3,4-SUBSTITUTED-PYRAZOLE-5-CARBOXYLIC ACID ESTER 株式会社日本ファインケム 2025-01-30 WO disclosed
CN-112119076-B Spiropiperidine allosteric modulators of nicotinic acetylcholine receptors 默沙东有限责任公司 2025-01-10 CN disclosed
EP-3788043-B1 SPIROPIPERIDINE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS MERCK SHARP & DOHME LLC (US) 2024-11-06 EP disclosed
CN-117986190-B Method for synthesizing ethyl trimethylpyrazole 德州新势立精细化工有限公司 2024-06-18 CN disclosed
CN-117986190-A Method for synthesizing ethyl trimethylpyrazole 德州新势立精细化工有限公司 2024-05-07 CN disclosed
CN-116768795-A Synthesis method of cyenopyrafen intermediate 湖南速博生物技术有限公司 2023-09-19 CN disclosed
CN-116768795-A Synthesis method of cyenopyrafen intermediate 湖南速博生物技术有限公司 2023-09-19 CN disclosed
CN-113354677-B Acrylonitrile compound and preparation method and application thereof 华中师范大学 2023-08-01 CN disclosed
US-20170137413-A1 NOVEL HALOGEN-SUBSTITUTED COMPOUNDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-05-18 US disclosed
US-20170114021-A1 HALOGEN-SUBSTITUTED COMPOUNDS BAYER ANIMAL HEALTH GMBH (DE) 2017-04-27 US disclosed
US-20150099766-A1 Novel halogen-substituted compounds BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-04-09 US disclosed
US-8946234-B2 Halogen-substituted compounds BAYER CROPSCIENCE AG (DE) 2015-02-03 US disclosed
WO-2012069601-A1 SUBSTITUTED QUINAZOLINES AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-05-31 WO disclosed
US-20110301181-A1 halogen-substituted compounds BAYER CROPSCIENCE AG (DE) 2011-12-08 US disclosed
CN-101410116-A Urotensin II receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2009-04-15 CN disclosed
JP-2008208047-A METHOD FOR PRODUCING 1,3,4-TRIMETHYLPYRAZOLE-5-CARBOXYLATE, AND INTERMEDIATE FOR PRODUCING THE SAME NISSAN CHEM IND LTD 2008-09-11 JP disclosed
EP-0891975-A1 PYRAZOLES AND AGRICULTURAL CHEMICALS CONTAINING THEM AS ACTIVE INGREDIENTS MITSUBISHI CHEMICAL CORPORATION (JP) 1999-01-20 EP 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-20170137413-A1 NOVEL HALOGEN-SUBSTITUTED COMPOUNDS CYP4F3, PYM1, PRDX4 MAPT 4585/4885L3MBTL1 35/4885POLB 3825/4885
US-20170114021-A1 HALOGEN-SUBSTITUTED COMPOUNDS PYM1, CYP4F3, ZYX MAPT 4541/4885L3MBTL1 26/4885POLB 3602/4885
US-20110301181-A1 halogen-substituted compounds L3MBTL4, QSOX1, L3MBTL3 MAPT 4184/4885L3MBTL1 4/4885POLB 1708/4885
US-20150099766-A1 Novel halogen-substituted compounds L3MBTL4, PRDX4, PRDX1 MAPT 4164/4885L3MBTL1 5/4885POLB 2153/4885

“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.