SCHEMBL2991264

SCHEMBL2991264

CC(C)(C)c1ccccc1-c1cccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.43
ALDH1A1 P00352 4/20 0.41
CYP2A6 P11509 2/20 0.41
CA2 P00918 1/20 0.41
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PPARD Q03181 1/20 0.41
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
SLC22A12 Q96S37 1/20 0.39
PRKDC P78527 1/20 0.39
HSD17B10 Q99714 1/20 0.39
DHFR P00374 1/20 0.39
TRPA1 O75762 1/20 0.38
PTPN1 P18031 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALPL P05186 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL15853162 0.86 HSD11B1 (0.41) KIF11ALDH1A1CYP2A6CA2PPARG
SCHEMBL17500087 0.85 CA2 (0.55) KIF11ALDH1A1CA2PPARGPPARA
SCHEMBL10010552 0.84 PPARG (0.42) ALDH1A1CYP2A6PPARGPPARACYP2C9
SCHEMBL27661667 0.82 TRPA1 (0.39) KIF11ALDH1A1CA2TSHRTDP1
SCHEMBL9405405 0.82 PPARG (0.41) ALDH1A1CYP2A6PPARGPPARACYP2C9
SCHEMBL4818310 0.82 KIF11 (0.48) KIF11ALDH1A1CYP2A6CA2CYP2C19
SCHEMBL252402 0.82 KIF11 (0.48) KIF11ALDH1A1CYP2A6CA2CYP2C19
SCHEMBL29972825 0.82 KIF11 (0.48) KIF11ALDH1A1CYP2A6CA2CYP2C19
SCHEMBL1194484 0.82 ALDH1A1 (0.55) KIF11ALDH1A1CA2TSHRTDP1
SCHEMBL6135770 0.81 TRPA1 (0.38) KIF11ALDH1A1CA2TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2009304-B1 TORQUE LIMITER JTEKT CORP (JP) 2014-10-01 EP disclosed
EP-2003353-B1 TORQUE LIMITER JTEKT CORP (JP) 2014-06-04 EP disclosed
US-8230986-B2 Torque limiter JTEKT CORPORATION (JP) 2012-07-31 US disclosed
US-8220609-B2 Torque limiter JTEKT CORPORATION (JP) 2012-07-17 US disclosed
US-20100184519-A1 TORQUE LIMITER JTEKT CORPORATION (JP) 2010-07-22 US disclosed
US-20090173591-A1 TORQUE LIMITER JTEKT CORPORATION (JP) 2009-07-09 US disclosed
EP-2009304-A1 TORQUE LIMITER JTEKT Corporation (JP) 2008-12-31 EP disclosed
EP-2003353-A1 TORQUE LIMITER JTEKT Corporation (JP) 2008-12-17 EP disclosed
CN-1051702-C Preparing process of amine derivative and fungusicide containing amine derivative SCIENT RESEARCH AND PHARMACEUT (JP) 2000-04-26 CN disclosed