SCHEMBL39676

SCHEMBL39676

O=C(Cl)c1cccc(CCl)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
ALDH1A1 P00352 1/20 0.47
FOLH1 Q04609 1/20 0.46
MRGPRX4 Q96LA9 2/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40

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
SCHEMBL29472003 1.00 TSHR (0.47) TSHRALDH1A1FOLH1MRGPRX4CA1
SCHEMBL7729812 0.88 MRGPRX4 (0.46) TSHRALDH1A1FOLH1MRGPRX4
SCHEMBL4950108 0.85 ALDH1A1 (0.48) TSHRALDH1A1FOLH1MRGPRX4CA1
SCHEMBL5207992 0.84 CYP4F2 (0.45) TSHRALDH1A1FOLH1MRGPRX4LOXL2
SCHEMBL46680 0.83 FOLH1 (0.66) FOLH1MRGPRX4CA1CA2
SCHEMBL16240333 0.83 PRSS1 (0.55) TSHRALDH1A1FOLH1LOXL2CYP4F2
SCHEMBL28410476 0.83 FOLH1 (0.46) TSHRFOLH1MRGPRX4CA1CA2
SCHEMBL46611 0.82 ALDH1A1 (0.46) TSHRALDH1A1FOLH1MRGPRX4LOXL2
SCHEMBL185773 0.82 PARP1 (0.57) TSHRFOLH1MRGPRX4
SCHEMBL18412078 0.82 ALDH1A1 (0.46) TSHRALDH1A1FOLH1MRGPRX4LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306629-A Preparation method of m-cyanomethyl benzoate 甘肃汉隆化工有限公司 2025-01-14 CN claimed
CN-115322240-B Cholesterol selenocyanate compound, and preparation method and application thereof 南宁师范大学 2023-09-12 CN claimed
CN-115322240-A Cholesterol selenocyanate compound and preparation method and application thereof 南宁师范大学 2022-11-11 CN claimed
CN-115260272-A Cholesterol selenocyanate compound and preparation method thereof 南宁师范大学 2022-11-01 CN claimed
CN-114957156-A Compound containing benzoxazine structure, resin composition, prepreg and electric copper clad laminate, and preparation method and application thereof 成都科宜高分子科技有限公司 2022-08-30 CN claimed
CN-111777528-A Preparation method of m-cyanomethyl benzoate 湖北仙盛科技股份有限公司 2020-10-16 CN claimed
CN-105384625-B A kind of synthetic method of 3 chloromethyl benzoic acid chlorides 湖北相和精密化学有限公司 2017-07-07 CN claimed
CN-106442971-A Immunodetection solid-phase carrier material, and preparation method and application thereof 中国科学院长春应用化学研究所 2017-02-22 CN claimed
CN-105384625-A 3-chloro methyl benzoyl chloride synthetic method HUBEI XIANGHE PREC CHEMICAL CO LTD 2016-03-09 CN claimed
CN-103013496-B Sulfhydryl group ion fuorescence probe and synthesis method thereof JIANGSU UNIVERSITY (CN) 2014-10-29 CN claimed
CN-101417995-B Phenoxy pyrimidine derivates and preparation method and use thereof YIJUN CHEN 2012-06-06 CN claimed
CN-101417995-A Phenoxy pyrimidine derivates and its production and use YIJUN CHEN (CN) 2009-04-29 CN claimed
CN-1058964-C Branched-amino-sbustituted thiazoles, processes for their preparation and the pharmaceutical compositions which contain them SANOFI SA (FR) 2000-11-29 CN claimed
EP-0659747-B1 Branched aminothiazole derivatives process for their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1998-04-01 EP claimed
CN-1127252-A Branched-amino-sbustituted thiazoles, processes for their preparation and the pharmaceutical compositions which contain them SANOFI SA (FR) 1996-07-24 CN claimed
EP-0518384-B1 Alkoxymethyl benzoic acid KUREHA CHEMICAL IND CO LTD (JP) 1995-09-06 EP claimed
EP-0297734-B1 A DERIVATIVE OF 1,5-DIPHENYL-1H-1,2,4-TRIAZOLE-3-CARBOXAMIDE, HERBICIDAL COMPOSITIONS CONTAINING THE DERIVATIVE AND PROCESS FOR PRODUCING THE DERIVATIVE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1993-03-03 EP claimed
EP-0518384-A1 Alkoxymethyl benzoic acid KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-12-16 EP claimed
EP-0440329-A1 S-substituted carbonyl substituted betathioacrylamide biocides and fungicides ROHM AND HAAS COMPANY (US) 1991-08-07 EP claimed
EP-0297734-A2 A derivative of 1,5-diphenyl-1H-1,2,4-triazole-3-carboxamide, herbicidal compositions containing the derivative and process for producing the derivative KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-01-04 EP claimed