SCHEMBL3672873

SCHEMBL3672873

Cc1cc(C(C)(C)C)c(O)c(C)c1CO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 6/20 0.52
LMNA P02545 4/20 0.52
CYP3A4 P08684 3/20 0.52
CYP1A2 P05177 3/20 0.52
TSHR P16473 3/20 0.52
HTR1A P08908 2/20 0.52
ADRA2A P08913 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CYP2D6 P10635 2/20 0.52
PTGS2 P35354 2/20 0.52
CHRM2 P08172 1/20 0.52
CHRM4 P08173 1/20 0.52
CHRM5 P08912 1/20 0.52
CHRM1 P11229 1/20 0.52
ADRA2B P18089 1/20 0.52
ADRA2C P18825 1/20 0.52
ADRA1D P25100 1/20 0.52
HTR1D P28221 1/20 0.52
HTR1B P28222 1/20 0.52

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
SCHEMBL30913173 1.00 CYP2C19 (0.52) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL30913172 1.00 CYP2C19 (0.52) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL10814873 0.86 CYP2C19 (0.61) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL10604162 0.85 CYP2C19 (0.40) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL10000643 0.85 CYP2C19 (0.52) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL10605065 0.84 CYP2C19 (0.49) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL30913183 0.83 CYP2C19 (0.51) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL9331710 0.83 CYP2C19 (0.58) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL1720100 0.83 CYP2C19 (0.51) CYP2C19LMNACYP3A4CYP1A2TSHR
SCHEMBL29824041 0.83 CYP2C19 (0.51) CYP2C19LMNACYP3A4CYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986196-A Clean preparation method of antioxidant 1790 巨野百林化学有限公司 2024-05-07 CN disclosed
CN-106699678-A Synthesis method of antioxidant 1790 兰州精细化工高新技术开发公司 2017-05-24 CN disclosed
US-7807757-B2 stabilizing and at the same time phase compatibilizing plastics or plastic compositions by incorporating maleic anhydride or acrylic acid grafted copolymer or terpolymer (styrene/butadiene/styrene block copolymer grafted with maleic anhydride) obtained by reacting with a benzotriazole compound CIBA SPECIALTY CHEMICALS CORP. (US) 2010-10-05 US disclosed
US-20080051521-A1 Functionalized polymers PFAENDNER RUDOLF 2008-02-28 US disclosed
US-7300978-B2 Functionalised polymers CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-11-27 US disclosed
US-20040167291-A1 Functionalised polymers PFAENDNER RUDOLF (DE) 2004-08-26 US disclosed
US-20020123577-A1 Functionalised polymers PFAENDNER RUDOLF (DE) 2002-09-05 US disclosed
US-6362278-B1 STABILIZATION USING STERIC HINDERED AMINE COMPOUND CIBA SPECIALTY CHEMICALS CORPORATION 2002-03-26 US disclosed
EP-0935619-B1 FUNCTIONALISED POLYMERS CIBA SC HOLDING AG (CH) 2001-06-20 EP disclosed
EP-0935619-A1 FUNCTIONALISED POLYMERS Ciba SC Holding AG (CH) 1999-08-18 EP disclosed
WO-1998018830-A1 FUNCTIONALISED POLYMERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1998-05-07 WO disclosed
US-3998863-A ANTIOXIDANTS AMERICAN CYANAMID COMPANY (US) 1976-12-21 US disclosed