SCHEMBL4250554

SCHEMBL4250554

c1ccc(CP(Cc2ccccc2)c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.43
CYP3A4 P08684 1/20 0.43
CALM1 P0DP23 1/20 0.43
EPHX2 P34913 1/20 0.40
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
LOXL2 Q9Y4K0 2/20 0.39
IDO1 P14902 2/20 0.39
TP53 P04637 1/20 0.39
TRPA1 O75762 1/20 0.39
HPGD P15428 2/20 0.38
ALOX12 P18054 2/20 0.38
MAOB P27338 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP2A6 P11509 1/20 0.36
HTR2A P28223 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36

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
SCHEMBL15660615 0.94 CALM1 (0.43) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL11657225 0.91 CYP3A4 (0.36) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL14609301 0.90 TDP1 (0.39) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL9883762 0.90 TDP1 (0.39) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL9883764 0.85 CYP3A4 (0.36) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL14609303 0.85 CYP3A4 (0.36) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL9883769 0.85 CYP3A4 (0.36) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL10024970 0.85 LOXL2 (0.44) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL4242743 0.85 TP53 (0.44) TDP1CYP3A4CALM1EPHX2TSHR
SCHEMBL8910966 0.85 DPP4 (0.32) TDP1CYP3A4CALM1EPHX2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114230434-B Method for producing trichlorobenzyl by directional chlorination of alkylbenzene 河南特格纳特科技有限公司 2024-01-26 CN claimed
CN-111689847-B Preparation method of aryl propionic acid compound 浙江新和成股份有限公司 2022-05-17 CN claimed
CN-114230434-A Method for producing trichlorobenzyl by directional chlorination of alkylbenzene and trichlorobenzyl 河南特格纳特科技有限公司 2022-03-25 CN claimed
CN-111689847-A Preparation method of aryl propionic acid compound 浙江新和成股份有限公司 2020-09-22 CN claimed
CN-110267936-A Carbonylation method and ligand combination object comprising bidentate phosphite ester ligand and tertiary phosphine antioxidant 佩什托普公司 2019-09-20 CN claimed
US-20020137820-A1 Phosphorus compounds SANDOZ LTD. (CH) 2002-09-26 US claimed
EP-0375573-B1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1993-03-17 EP claimed
EP-0449966-A1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1991-10-09 EP claimed
US-4960949-A RHODIUM-PHOSPHINE COMPLEX; HIGH SELECTIVITY EASTMAN KODAK COMPANY (US) 1990-10-02 US claimed
WO-1990006810-A1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1990-06-28 WO claimed
EP-0375573-A1 Low pressure rhodium catalyzed hydroformylation of olefins EASTMAN KODAK COMPANY (US) 1990-06-27 EP claimed
JP-9176365-A None JP disclosed
CN-114206819-B Process for reducing heavy ends formation and catalyst loss in hydroformylation processes 佩什托普公司 2024-06-25 CN disclosed
CN-114230434-B Method for producing trichlorobenzyl by directional chlorination of alkylbenzene 河南特格纳特科技有限公司 2024-01-26 CN disclosed
US-11834527-B1 Poly alpha-olefins, compositions thereof, and methods of making Western Performance Chemicals, LLC (US) 2023-12-05 US disclosed
US-4342680-A WITH AN AMINE SUBSTITUTED TRIAZINE, A PHENOL, AND AN ALKALI METAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1982-08-03 US disclosed
US-4339569-A BULK POLYMERIZATION, BORON TRIFLUORIDE CATALYSTS MITSUBISHI GAS CHEMICAL CO., INC. (JP) 1982-07-13 US disclosed
US-4125540-A WITH ORGANO-PHOSPHORUS COMPOUNDS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1978-11-14 US disclosed
US-4087411-A TRIOXANE, BORON FLUORIDE-TYPE CATALYST MITSUBISHI GAS CHEMICAL COMPANY, INC. (JA) 1978-05-02 US disclosed
US-4069243-A Preparation of trifluoromethylthioacetic acid and its esters SMITHKLINE CORPORATION (US) 1978-01-17 US disclosed