SCHEMBL3421628

SCHEMBL3421628

C=C(C(=O)O)c1ccc2cc(OC)ccc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.69
CYP1A2 P05177 4/20 0.58
ALDH1A1 P00352 1/20 0.58
HPGD P15428 1/20 0.58
CYP2C19 P33261 1/20 0.58
HSD17B10 Q99714 1/20 0.58
AKR1C3 P42330 4/20 0.50
AKR1C2 P52895 4/20 0.50
PTGS1 P23219 3/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NPC1 O15118 1/20 0.50
PLAU P00749 1/20 0.50
PTGS2 P35354 3/20 0.49
CDC42 P60953 1/20 0.49
RAC1 P63000 1/20 0.49
TSHR P16473 1/20 0.49
SLC22A6 Q4U2R8 1/20 0.49
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48

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
SCHEMBL30577888 1.00 KDM4E (0.69) KDM4ECYP1A2ALDH1A1HPGDCYP2C19
SCHEMBL9301384 0.85 KDM4E (0.62) KDM4ECYP1A2ALDH1A1HPGDCYP2C19
SCHEMBL11856961 0.85 KDM4E (0.49) KDM4ECYP1A2ALDH1A1HPGDCYP2C19
SCHEMBL562943 0.83 CA1 (0.63) CYP1A2ALDH1A1HPGDMEN1KMT2A
SCHEMBL11780406 0.82 KDM4E (0.73) KDM4ECYP1A2ALDH1A1HPGDCYP2C19
SCHEMBL14339888 0.82 KDM4E (0.58) KDM4ECYP1A2ALDH1A1HPGDCYP2C19
SCHEMBL34463427 0.82 KDM4E (1.00) KDM4ECYP1A2ALDH1A1HPGDCYP2C19
SCHEMBL8132 0.82 KDM4E (1.00) KDM4ECYP1A2ALDH1A1HPGDCYP2C19
SCHEMBL6152954 0.81 CES2 (0.65) ALDH1A1MEN1KMT2ANPC1TSHR
Hydrochloric Acid SCHEMBL3541422 0.80 KDM4E (0.96) KDM4ECYP1A2ALDH1A1HPGDCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116732537-A New synthesis method of naproxen 上海颐碳化学科技有限公司 2023-09-12 CN claimed
EP-0954375-A4 NOVEL SUPPORTED CATALYSTS SETON HALL UNIVERSITY (US) 2000-06-21 EP claimed
US-6005148-A COMPRISING SUPPORT, ANCHORING AGENT SUCH AS HETEROPOLY ACID OR ANION, AND METAL COMPLEX USEFUL IN HYDROGENATION OF SUBSTITUTED UNSATURATED ACIDS AND ESTERS SETON HALL UNIVERSITY (US) 1999-12-21 US claimed
WO-1999064154-A1 POLY-OXYANIONS AS ANCHORING AGENTS FOR METAL COMPLEXES SETON HALL UNIVERSITY (US) 1999-12-16 WO claimed
US-5990318-A Soluble polyester-supported chiral phosphines THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 1999-11-23 US claimed
EP-0954375-A1 NOVEL SUPPORTED CATALYSTS Seton Hall University (US) 1999-11-10 EP claimed
WO-1998028074-A1 NOVEL SUPPORTED CATALYSTS SETON HALL UNIVERSITY (US) 1998-07-02 WO claimed
EP-0433424-B1 IMPROVED ASYMMETRIC CATALYTIC HYDROGENATION OF ALPHA-ARYLPROPENOIC ACIDS MONSANTO CO (US) 1995-05-24 EP claimed
EP-0633238-A2 Asymmetric catalytic hydrogenation of alpha-arylpropenoic acids MONSANTO COMPANY (US) 1995-01-11 EP claimed
EP-0561908-A1 METHOD FOR PREPARING $g(a)-ARYLPROPIONIC ACIDS MONSANTO COMPANY (US) 1993-09-29 EP claimed
US-5233084-A Electrochemical carboxylation; dehydration, catalytic asymetric hydrogenation MONSANTO COMPANY (US) 1993-08-03 US claimed
US-5202474-A Forming alpha-arylpropionic acid by using a coordination catalysts MONSANTO COMPANY (US) 1993-04-13 US claimed
WO-1992009552-A1 METHOD FOR PREPARING α-ARYLPROPIONIC ACIDS MONSANTO COMPANY (US) 1992-06-11 WO claimed
EP-0275354-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE ARYLACETIC ACID DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-10-16 EP claimed
EP-0433424-A1 IMPROVED ASYMMETRIC CATALYTIC HYDROGENATION OF ALPHA-ARYLPROPENOIC ACIDS. MONSANTO CO (US) 1991-06-26 EP claimed
US-4994607-A Using a rhodium or ruthenium coordination complex of a chiral phosphine compound MONSANTO COMPANY (US) 1991-02-19 US claimed
WO-1990015790-A1 IMPROVED ASYMMETRIC CATALYTIC HYDROGENATION OF ALPHA-ARYLPROPENOIC ACIDS MONSANTO COMPANY (US) 1990-12-27 WO claimed
US-4762948-A USING METALLOCENYL PHOSPHINE REDUCING AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-08-09 US claimed
US-4239914-A Process for preparing 2-(6'-methoxy-2'-naphthyl)-propionic acid MONTEDISON S.P.A. (IT) 1980-12-16 US claimed
US-3994968-A 2-(5'-Halo-6'-methoxynaphth-2'-yl)-acrylic acid SYNTEX CORPORATION (PM) 1976-11-30 US claimed