SCHEMBL4367993

SCHEMBL4367993

CC1(C)CC(C)(c2ccccc2O)c2ccccc2O1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.35
OPRM1 P35372 1/20 0.35
OPRK1 P41145 1/20 0.35
AKR1B1 P15121 2/20 0.33
CNR1 P21554 1/20 0.33
AKT1 P31749 1/20 0.33
CTSD P07339 1/20 0.31
BACE1 P56817 1/20 0.31
ALDH1A1 P00352 2/20 0.30
MAPT P10636 1/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL31545782 0.86 MAPT (0.38) AKR1B1ALDH1A1MAPTKDM4EPOLB
SCHEMBL29485709 0.81 MAPT (0.40) AKR1B1CNR1ALDH1A1MAPTKDM4E
SCHEMBL2418797 0.81 MAPT (0.40) AKR1B1CNR1ALDH1A1MAPTKDM4E
SCHEMBL7738248 0.78 MEN1 (0.48) AKR1B1CNR1ALDH1A1MAPTPOLB
SCHEMBL7740730 0.77 LMNA (0.35) AKR1B1CNR1CTSDBACE1ALDH1A1
SCHEMBL18634917 0.77 OPRD1 (0.39) OPRD1OPRM1OPRK1ALDH1A1MAPT
SCHEMBL6911184 0.77 DHFR (0.40) OPRD1OPRM1AKR1B1CTSDBACE1
SCHEMBL8343455 0.75 BACE1 (0.36) AKR1B1CTSDBACE1
SCHEMBL8561686 0.74 AKR1B1 (0.35) AKR1B1CTSDBACE1ALDH1A1
SCHEMBL15886242 0.74 ATM (0.35) CTSDBACE1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0638057-B1 RECOVERING VALUES FROM HEAVY ENDS IN BISPHENOL-A PRODUCTION ARISTECH CHEMICAL CORP (US) 1999-09-08 EP claimed
US-5730954-A Preparation comprising cavitate- or clathrate-forming host/guest complexes as contrast agent SCHERING AKTIENGESELLSCHAFT (DE) 1998-03-24 US claimed
EP-0638057-A4 RECOVERING VALUES FROM HEAVY ENDS IN BISPHENOL-A PRODUCTION. ARISTECH CHEMICAL CORP (US) 1996-10-23 EP claimed
EP-0638057-A1 RECOVERING VALUES FROM HEAVY ENDS IN BISPHENOL-A PRODUCTION Aristech Chemical Corporation (US) 1995-02-15 EP claimed
WO-1994020445-A1 RECOVERING VALUES FROM HEAVY ENDS IN BISPHENOL-A PRODUCTION ARISTECH CHEMICAL CORPORATION (US) 1994-09-15 WO claimed
US-5300702-A Purifying the waste mixture consisting of the isomers, phenol, 2,2,4-trimethyl-4-hydroxyphenyl-chroman by evaporating into heavy and light streams and distill to separate the light stream ARISTECH CHEMICAL CORPORATION (US) 1994-04-05 US claimed
JP-57076018-A None JP disclosed
JP-56047238-A None JP disclosed
WO-2023027037-A1 MOLD MATERIAL FOR SHELL MOLDS 旭有機材株式会社 2023-03-02 WO disclosed
US-7579075-B2 Phenolic novolak resin for shell mold, process for producing the same, and resin coated sand ASAHI ORGANIC CHEMICALS INDUSTRY CO., LTD. (JP) 2009-08-25 US disclosed
US-20080171205-A1 PHENOLIC NOVOLAK RESIN FOR SHELL MOLD, PROCESS FOR PRODUCING THE SAME, AND RESIN COATED SAND ASAHI ORGANIC CHEMICALS INDUSTRY CO., LTD. (JP) 2008-07-17 US disclosed
US-6756432-B2 POLYBUTADIENE TYPE POLYMER WITH A 1-BENZOPYRAN, A 1-BENZO PYRAN-2-ONE OR A BENZOIN DERIVATIVE; MOLDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-06-29 US disclosed
US-20030153655-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-08-14 US disclosed
EP-0765851-A2 Preparation of 2,2'-bis(4-hydroxyphenyl)propanes in the presence of organopolysiloxanes containing sulphonate and mercapto groups Degussa Aktiengesellschaft (DE) 1997-04-02 EP disclosed
EP-0638057-A4 RECOVERING VALUES FROM HEAVY ENDS IN BISPHENOL-A PRODUCTION. ARISTECH CHEMICAL CORP (US) 1996-10-23 EP disclosed
EP-0638057-A1 RECOVERING VALUES FROM HEAVY ENDS IN BISPHENOL-A PRODUCTION Aristech Chemical Corporation (US) 1995-02-15 EP disclosed
WO-1994020445-A1 RECOVERING VALUES FROM HEAVY ENDS IN BISPHENOL-A PRODUCTION ARISTECH CHEMICAL CORPORATION (US) 1994-09-15 WO disclosed
US-5300702-A Purifying the waste mixture consisting of the isomers, phenol, 2,2,4-trimethyl-4-hydroxyphenyl-chroman by evaporating into heavy and light streams and distill to separate the light stream ARISTECH CHEMICAL CORPORATION (US) 1994-04-05 US disclosed
JP-S5776018-A PREPARATION OF PHENOLIC RESIN FOR FELT AISIN CHEM CO LTD 1982-05-12 JP disclosed
JP-S5647238-A BINDER FOR SELF-HARDENING MOLD HITACHI CHEM CO LTD 1981-04-28 JP disclosed