SCHEMBL4626530

SCHEMBL4626530

Cc1ccc(C)c(O)c1C.Cc1cccc(C)c1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.74
TRPA1 O75762 2/20 0.56
ATM Q13315 2/20 0.56
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
POLB P06746 1/20 0.40
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KMT2A Q03164 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2A6 P11509 1/20 0.39
TSHR P16473 2/20 0.38
ACHE P22303 1/20 0.38
CA1 P00915 2/20 0.38

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
SCHEMBL23915 0.89 ALDH1A1 (0.53) ALDH1A1TRPA1ATMGABRA1GABRB2
SCHEMBL15485256 0.89 ALDH1A1 (0.53) ALDH1A1TRPA1ATMGABRA1GABRB2
SCHEMBL29407125 0.89 ALDH1A1 (0.53) ALDH1A1TRPA1ATMGABRA1GABRB2
SCHEMBL2500374 0.86 ALDH1A1 (1.00) ALDH1A1TRPA1ATMGABRA1GABRB2
SCHEMBL11575272 0.86 ALDH1A1 (1.00) ALDH1A1TRPA1ATMGABRA1GABRB2
SCHEMBL64141 0.86
Water SCHEMBL29374093 0.83 ALDH1A1 (0.48) ALDH1A1TRPA1ATMGABRA1GABRB2
Orthocresol SCHEMBL10802827 0.83 TRPA1 (0.56) ALDH1A1TRPA1ATMGABRA1GABRB2
Resorcinol SCHEMBL10383035 0.83 ALDH1A1 (0.55) ALDH1A1TRPA1ATMGABRA1GABRB2
SCHEMBL29012437 0.83 TRPA1 (0.62) ALDH1A1TRPA1ATMGABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111819219-A Process for producing poly (vinylbenzyl) ether compound 第一工业制药株式会社 2020-10-23 CN disclosed
WO-2019176855-A1 METHOD FOR PRODUCING POLY(VINYLBENZYL)ETHER COMPOUND 第一工業製薬株式会社 2019-09-19 WO disclosed
EP-1319040-B1 POLYMER-ORGANOCLAY COMPOSITE COMPOSITIONS, METHOD FOR MAKING AND ARTICLES THEREFROM SABIC INNOVATIVE PLASTICS IP (NL) 2014-08-20 EP disclosed
EP-1338016-B1 ELECTRICALLY CONDUCTIVE POLYMER COMPOSITE COMPOSITIONS, METHOD FOR MAKING, AND METHOD FOR ELECTRICAL CONDUCTIVITY ENHANCEMENT GEN ELECTRIC (US) 2008-06-18 EP disclosed
CN-100374491-C Polymer-organoclay composite compositions, method for making and article therefrom GEN ELECTRIC (US) 2008-03-12 CN disclosed
US-20060106164-A1 Antistatic agent and coating or molding synthetic resins SUZUKA FUJI XEROX CO., LTD. (JP) 2006-05-18 US disclosed
CN-1229818-C Electrically conductive polymer composite compositions, method for making, and method for electrical conductivity enhancement GEN ELECTRONIC CO (US) 2005-11-30 CN disclosed
EP-1595931-A1 ANTISTATIC AGENT AND COATING OR MOLDING SYNTHETIC RESINS Suzuka Fuji Xerox Co., Ltd. (JP) 2005-11-16 EP disclosed
CN-1471713-A Electrically conductive polymer composite compositions, method for making, and method for electrical conductivity enhancement 通用电气公司 2004-01-28 CN disclosed
CN-1461328-A Polymer-organoclay composite compositions, method for making and article therefrom GEN ELECTRIC (US) 2003-12-10 CN disclosed
US-5869184-A RESIN RAW MATERIALS FOR PAINTS, ADHESIVES MITSUI TOATSU CHEMICALS, INC. (JP) 1999-02-09 US disclosed
US-5744504-A AMINO RESIN; THERMOSETTING MOLDING MATERIALS MITSUI TOATSU CHEMICALS, INC. (JP) 1998-04-28 US disclosed
US-5648446-A ADHESIVES, FIREPROOFING, HEAT RESISTANCE IN RESINS FOR MOLDING MATERIALS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-15 US disclosed
US-5646240-A THERMOSETTING MOLDING COMPOSITIONS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-08 US disclosed
US-5596039-A FLAME RETARDERS, HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-21 US disclosed
US-5569726-A USEFUL IN FLAME-RETARDING, THERMAL STABILIZATION AND COMPATIBILIZATION OF RESINS AND IN THERMOSETTING MOLDING COMPOSITIONS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-10-29 US disclosed
US-5545702-A THERMOSETTING RESIN COMPOSITION MITSUI TOATSU CHEMICALS, INC. (JP) 1996-08-13 US disclosed
US-5536795-A ADHESIVES AND PAINTS AND FIREPROOFING THERMOSETTING RESINS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-07-16 US disclosed
US-5480947-A N-METHYLOL DIGUANAMINES MITSUI TOATSU CHEMICALS, INC. (JP) 1996-01-02 US disclosed
EP-0612797-A2 Modification method of resins MITSUI TOATSU CHEMICALS, Inc. (JP) 1994-08-31 EP disclosed