SCHEMBL855518

SCHEMBL855518

CC(C)(C)CC(C(=O)OO)C(C)(C)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSS P25774 1/20 0.38
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
CHRM2 P08172 3/20 0.36
CHRM1 P11229 3/20 0.36
CHRM3 P20309 3/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
KCNN4 O15554 1/20 0.36
KIF11 P52732 1/20 0.36
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35

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
SCHEMBL168725 0.81 RIPK1 (0.36) CYP2C19HIF1AALDH1A1ALOX15MAPT
SCHEMBL2707979 0.79 ALDH1A1 (0.43) ALDH1A1CTSLCTSBCTSSMAPT
SCHEMBL786199 0.78 ALDH1A1 (0.45) ALDH1A1MAPTKMT2ACHRM2HDAC3
SCHEMBL28355096 0.78 ALDH1A1 (0.45) CYP2C19HIF1AALDH1A1ALOX15MAPT
SCHEMBL14843728 0.77 RIPK1 (0.30)
SCHEMBL232737 0.75 ALDH1A1 (0.42) CYP2C19HIF1AALDH1A1ALOX15MAPT
SCHEMBL284234 0.73
SCHEMBL1028846 0.72 KMT2A (0.44) CYP2C19HIF1AALDH1A1MAPTKMT2A
SCHEMBL11588039 0.72 CYP2C19 (0.41) CYP2C19HIF1AALDH1A1ALOX15CTSL
SCHEMBL4377967 0.70 CYP2C19 (0.46) CYP2C19HIF1AMAPTKMT2AKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4103548-B1 COMPOSITION COMPRISING AT LEAST ONE ORGANIC PEROXIDE, AT LEAST ONE EMULSIFIER, AND HYDROGEN PEROXIDE ARKEMA FRANCE (FR) 2023-11-08 EP claimed
EP-3710503-B1 FUNCTIONALIZED POLYMERS EVONIK OPERATIONS GMBH (DE) 2022-01-05 EP claimed
EP-2970538-B1 POLYMERIZATION PROCESS PROTECTION MEANS DUPONT ELECTRONICS INC (US) 2021-10-20 EP claimed
EP-3344635-B1 METHOD FOR THE PREPARATION OF CYANOHYDRIN ESTERS CONTAINING PHOSPHORUS BASF SE (DE) 2019-08-07 EP claimed
EP-3143030-B1 METHOD FOR THE PREPARATION OF CYANOHYDRINS CONTAINING PHOSPHORUS BASF SE (DE) 2019-07-17 EP claimed
EP-2952542-B1 BULK PVC COMPOSITION AND BULK PVC POLYMERIZATION METHOD LG CHEMICAL LTD (KR) 2019-01-02 EP claimed
EP-3344635-A1 METHOD FOR PRODUCING CYANOHYDRIN ESTERS CONTAINING PHOSPHOROUS Bayer CropScience Aktiengesellschaft (DE) 2018-07-11 EP claimed
EP-3143030-A1 PROCESS FOR PREPARING PHOSPHORUS-CONTAINING CYANOHYDRINS Bayer CropScience Aktiengesellschaft (DE) 2017-03-22 EP claimed
WO-2017037009-A1 METHOD FOR PRODUCING CYANOHYDRIN ESTERS CONTAINING PHOSPHOROUS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-03-09 WO claimed
WO-2015173146-A1 PROCESS FOR PREPARING PHOSPHORUS-CONTAINING CYANOHYDRINS BAYER CROPSCIENCE AG (DE) 2015-11-19 WO claimed
EP-2010575-B1 PROCESS OF FREE-RADICAL POLYMERIZATION OR CROSSLINKING IN THE PRESENCE OF A SELECTED ORGANIC PEROXIDE PREPARED BY AN EX SITU PROCESS ARKEMA FRANCE (FR) 2015-07-01 EP claimed
EP-2010484-B1 PROCESS FOR SYNTHESIZING SELECTED ORGANIC PEROXIDES ARKEMA FRANCE (FR) 2012-09-19 EP claimed
EP-1360069-B1 IN SITU MICROENCAPSULATED ADHESIVE APPLETON PAPER INC (US) 2010-02-10 EP claimed
EP-0355997-B1 POLYMERISATION PROCESS AND CATALYST SYSTEM THEREFOR POLYSAR LIMITED (CA) 1993-09-15 EP claimed
US-4943616-A LEWIS ACID AND PEROXIDE, ISOBUTYLENE POLYSAR LIMITED (CA) 1990-07-24 US claimed
US-4908421-A Charging isobutylene, organic peroxy compound, Lewis acid to reaction vessel, polymerizing POLYSAR LIMITED (CA) 1990-03-13 US claimed
EP-0355997-A2 Polymerisation process and catalyst system therefor POLYSAR LIMITED (CA) 1990-02-28 EP claimed
CN-111556880-B Ethylene copolymer and process for producing the same SABIC环球技术有限责任公司 2023-02-28 CN disclosed
US-4908421-A Charging isobutylene, organic peroxy compound, Lewis acid to reaction vessel, polymerizing POLYSAR LIMITED (CA) 1990-03-13 US disclosed
EP-0355997-A2 Polymerisation process and catalyst system therefor POLYSAR LIMITED (CA) 1990-02-28 EP disclosed