SCHEMBL7185145

SCHEMBL7185145

CC(C)Cc1ccc(/C=C/c2ccc(CC(C)C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
MEN1 O00255 1/20 0.51
POLB P06746 1/20 0.51
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
CHRM1 P11229 1/20 0.46
PDE4A P27815 1/20 0.46
PTGS1 P23219 3/20 0.45
PTGS2 P35354 3/20 0.45
LMNA P02545 2/20 0.45
CYP2C9 P11712 2/20 0.45
AKR1C3 P42330 2/20 0.45
CXCR1 P25024 2/20 0.45
CXCR2 P25025 2/20 0.45
ALOX5 P09917 2/20 0.45
ALB P02768 1/20 0.45
ESR1 P03372 1/20 0.45

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
SCHEMBL9576148 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL7185147 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL16105619 0.91 NPC1 (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL16105618 0.91 NPC1 (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL6546298 0.91 NPC1 (0.46) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL4371655 0.89 NPC1 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL4372138 0.89 NPC1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL4378115 0.89 NPC1 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL4378113 0.89 NPC1 (0.49) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1
SCHEMBL4372142 0.89 NPC1 (0.45) NPC1RAB9ASMN1; SMN2ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0293633-B1 1,2-DI(4-ISOBUTYLPHENYL)ETHYLENE AND ITS PREPARATION AND USE AS INTERMEDIATE NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1993-03-10 EP claimed
EP-0470651-A1 1,2-Di(4-isobutylphenyl) ethane and its preparation and use as intermediate NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-02-12 EP claimed
US-4885419-A IBUPROFEN NIPPON PETROCHEMICALS COMPANY, LTD. (JP) 1989-12-05 US claimed
EP-0293633-A2 1,2-Di(4-isobutylphenyl)ethylene and its preparation and use as intermediate NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-12-07 EP claimed
JP-63275532-A None JP disclosed
JP-63275531-A None JP disclosed
EP-0961763-B1 PREPARATION OF OLEFINIC COMPOUNDS AND CARBOXYLIC DERIVATIVES THEREOF ALBEMARLE CORP (US) 2003-04-02 EP disclosed
US-6080888-A REACTING ARYL HALIDE WITH AN OLEFINIC COMPOUND IN THE PRESENCE OF A POLAR LIQUID REACTION MEDIUM CONTAINING A SECONDARY OR TERTIARY AMINE AS A HYDROGEN HALIDE ACCEPTOR, A CATALYST SYSTEM FORMED FROM PALLADIUM, A PHOSPHINE ALBEMARLE CORPORATION (US) 2000-06-27 US disclosed
EP-0961763-A1 PREPARATION OF OLEFINIC COMPOUNDS AND CARBOXYLIC DERIVATIVES THEREOF ALBEMARLE CORPORATION (US) 1999-12-08 EP disclosed
WO-1998030522-A1 PREPARATION OF OLEFINIC COMPOUNDS AND CARBOXYLIC DERIVATIVES THEREOF ALBEMARLE CORPORATION (US) 1998-07-16 WO disclosed
EP-0809618-A1 PROCESS FOR PREPARING OLEFINS ALBEMARLE CORPORATION (US) 1997-12-03 EP disclosed
WO-1996025376-A1 PROCESS FOR PREPARING OLEFINS ALBEMARLE CORPORATION (US) 1996-08-22 WO disclosed
EP-0290050-B1 METHOD FOR PRODUCING ALKYLSTYRENE NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-08-21 EP disclosed
US-5026939-A Cracking 1,2-di(4-isobutylphenyl)ethane in contact with acid catalyst NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-06-25 US disclosed
US-4885419-A IBUPROFEN NIPPON PETROCHEMICALS COMPANY, LTD. (JP) 1989-12-05 US disclosed
EP-0293633-A2 1,2-Di(4-isobutylphenyl)ethylene and its preparation and use as intermediate NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-12-07 EP disclosed
EP-0293633-A2 1,2-Di(4-isobutylphenyl)ethylene and its preparation and use as intermediate NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-12-07 EP disclosed
JP-S63275531-A PRODUCTION OF 4-ISOBUTYLSTYRENE NIPPON PETROCHEM CO LTD 1988-11-14 JP disclosed
JP-S63275532-A 1,2-DI(4-ISOBUTYLPHENYL)ETHYLENE NIPPON PETROCHEM CO LTD 1988-11-14 JP disclosed
EP-0290050-A1 Method for producing alkylstyrene NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1988-11-09 EP disclosed