SCHEMBL9508370

SCHEMBL9508370

COOC(C)(C)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.76
ALDH1A1 P00352 3/20 0.56
ALOX15 P16050 1/20 0.56
KCNN4 O15554 4/20 0.40
TAAR1 Q96RJ0 1/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
CES1 P23141 1/20 0.36
TSHR P16473 2/20 0.36
CA4 P22748 1/20 0.36
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 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
SCHEMBL8939342 0.87 MAPK1 (1.00) MAPK1ALDH1A1ALOX15KCNN4TAAR1
Benzene SCHEMBL25312146 0.87 MAPK1 (1.00) MAPK1ALDH1A1ALOX15KCNN4TAAR1
SCHEMBL15450 0.87 MAPK1 (1.00) MAPK1ALDH1A1ALOX15KCNN4TAAR1
SCHEMBL27506519 0.87 MAPK1 (1.00) MAPK1ALDH1A1ALOX15KCNN4TAAR1
SCHEMBL30089546 0.84 MAPK1 (0.94) MAPK1ALDH1A1ALOX15KCNN4TAAR1
SCHEMBL28492385 0.84 MAPK1 (0.94) MAPK1ALDH1A1ALOX15KCNN4TAAR1
Ethane SCHEMBL28682771 0.84 MAPK1 (0.94) MAPK1ALDH1A1ALOX15KCNN4TAAR1
SCHEMBL8830147 0.84 MAPK1 (0.94) MAPK1ALDH1A1ALOX15KCNN4TAAR1
Hydrogen Peroxide SCHEMBL22163808 0.84 MAPK1 (0.94) MAPK1ALDH1A1ALOX15KCNN4TAAR1
SCHEMBL31655460 0.84 MAPK1 (0.94) MAPK1ALDH1A1ALOX15KCNN4TAAR1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11485921-B2 Fuel composition of diesel fuel ARISTOV ANDREY VIACHESLAVOVICH (RU) 2022-11-01 US 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
US-20230053569-A1 FUEL COMPOSITION OF DIESEL FUEL ARISTOV ANDREY VIACHESLAVOVICH (RU) 2023-02-23 US disclosed
US-20230053569-A1 FUEL COMPOSITION OF DIESEL FUEL ARISTOV ANDREY VIACHESLAVOVICH (RU) 2023-02-23 US disclosed
US-11485921-B2 Fuel composition of diesel fuel ARISTOV ANDREY VIACHESLAVOVICH (RU) 2022-11-01 US disclosed
US-11485921-B2 Fuel composition of diesel fuel ARISTOV ANDREY VIACHESLAVOVICH (RU) 2022-11-01 US disclosed
EP-0355997-B1 POLYMERISATION PROCESS AND CATALYST SYSTEM THEREFOR POLYSAR LIMITED (CA) 1993-09-15 EP disclosed
US-4943616-A LEWIS ACID AND PEROXIDE, ISOBUTYLENE POLYSAR LIMITED (CA) 1990-07-24 US 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
EP-0060356-A1 Composite building panel LINX BUILDING SYSTEMS CORPORATION (US) 1982-09-22 EP disclosed
US-4327536-A Composite building panel LINX BUILDING SYSTEMS CORP. (US) 1982-05-04 US disclosed