SCHEMBL9348366

SCHEMBL9348366

CC(C)CCc1cccc(C(C)(C)C)c1O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.53
GABRA1 P14867 3/20 0.47
GABRB2 P47870 3/20 0.47
ATM Q13315 1/20 0.43
ALOX12 P18054 1/20 0.40
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
HSPA5 P11021 2/20 0.36
IAPP P10997 3/20 0.36
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
DHODH Q02127 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
SCHEMBL9348257 0.87 CA2 (0.47) CA2GABRA1GABRB2ATMALOX12
SCHEMBL6559322 0.83 GABRA1 (0.61) CA2GABRA1GABRB2TSHRCYP1A2
SCHEMBL8324365 0.82 GABRA1 (0.68) CA2GABRA1GABRB2ATMALOX12
SCHEMBL9348414 0.80 GABRA1 (0.65) GABRA1GABRB2IAPPDHODH
SCHEMBL7065972 0.80 CA2 (0.59) CA2GABRA1GABRB2ATMALOX12
SCHEMBL3809080 0.80 CA2 (0.59) CA2GABRA1GABRB2ATMALOX12
SCHEMBL430927 0.79 CA2 (0.57) CA2GABRA1GABRB2ATMALOX12
SCHEMBL6345729 0.78 IAPP (0.55) CA2GABRA1GABRB2ALDH1A1TDP1
SCHEMBL9994746 0.78 CA2 (0.61) CA2GABRA1GABRB2ATMALOX12
SCHEMBL57139 0.77 GABRA1 (0.67) CA2GABRA1GABRB2ATMALOX12

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
CN-100516031-C Organic multiple isocyanate composition MITSUI TAKEDA CHEMICAL CO LTD (JP) 2009-07-22 CN disclosed
CN-1626509-A Organic multiple isocyanate compsn. MITSUI TAKEDA CHEMICAL CO LTD (JP) 2005-06-15 CN disclosed
EP-0258598-B1 N-(substituted-1-piperazinealkyl)-alpha-(3,5-di-alkyl-4-hydroxyphenyl)-alpha,alpha-dialkyl acetamides GOODRICH CO B F (US) 1994-09-07 EP disclosed
CN-1022915-C Process for preparing N, alpha-substituted acetamide GOODRICH CO B F (US) 1993-12-01 CN disclosed
EP-0253010-B1 N-(SUBSTITUTED CYCLIC ALKYLENEIMINE)-ALPHA-(3,5-DI-ALKYL-4-HYDROXY-PHENYL)-ALPHA, ALPHA-DIALKYL ACETAMIDES The B.F. GOODRICH Company (US) 1992-12-02 EP disclosed
US-5096949-A Heat and oxidation resistance, photostability; polyolefins; uv rad THE B. F. GOODRICH COMPANY (US) 1992-03-17 US disclosed
US-4920228-A N,N-disubstituted, α-(3,5-dialkyl-4-hydroxyphenyl)-α,α-disubstituted acetamides and composition stabilized therewith THE B. F. GOODRICH COMPANY (US) 1990-04-24 US disclosed
US-4780495-A HEAT, OXIDATION, AND LIGHT STABILIZERS THE B. F. GOODRICH COMPANY (US) 1988-10-25 US disclosed
EP-0284800-A1 N-(substituted piperidinyl)-alpha-(3,5-dialkyl-4-hydroxyphenyl)-alpha', alpha''-dialkyl acetamides THE B.F. GOODRICH COMPANY (US) 1988-10-05 EP disclosed
EP-0141419-B1 3,5-DIALKYL-4-HYDROXYPHENYL-SUBSTITUTED DERIVATIVES The B.F. GOODRICH Company (US) 1988-03-09 EP disclosed
EP-0258598-A2 N-(substituted-1-piperazinealkyl)-alpha-(3,5-di-alkyl-4-hydroxyphenyl)-alpha,alpha-dialkyl acetamides THE B.F. GOODRICH COMPANY (US) 1988-03-09 EP disclosed
EP-0253010-A1 N-(substituted cyclic alkyleneimine)-alpha-(3,5-di-alkyl-4-hydroxy-phenyl)-alpha, alpha-dialkyl acetamides The B.F. GOODRICH Company (US) 1988-01-20 EP disclosed
US-4523032-A 3,5-Dialkyl-4-hydroxyphenyl-substituted acetic acids THE B. F. GOODRICH COMPANY (US) 1985-06-11 US disclosed
EP-0141419-A1 3,5-Dialkyl-4-hydroxyphenyl-substituted derivatives The B.F. GOODRICH Company (US) 1985-05-15 EP disclosed