SCHEMBL1194499

SCHEMBL1194499

CC(C)CN(Sc1nc2ccccc2s1)C(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.48
CYP2D6 P10635 4/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C19 P33261 2/20 0.48
MAPK1 P28482 1/20 0.48
HIF1A Q16665 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ALDH1A1 P00352 5/20 0.47
FBP1 P09467 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
ADRA2A P08913 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
DRD2 P14416 1/20 0.47
ALOX15 P16050 1/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
DRD1 P21728 1/20 0.47
MC5R P33032 1/20 0.47
OPRM1 P35372 1/20 0.47

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
SCHEMBL1419448 0.88 FBP1 (0.50) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1
SCHEMBL1194363 0.85 FBP1 (0.47) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1
SCHEMBL1193757 0.85 FBP1 (0.54) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1
SCHEMBL1193524 0.82 FBP1 (0.51) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1
SCHEMBL1820077 0.81 ALDH1A1 (0.41) MAPK1L3MBTL1ALDH1A1HPGDALOX15
SCHEMBL1193557 0.80 ALDH1A1 (0.49) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1
SCHEMBL3477077 0.80 L3MBTL1 (0.47) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1
SCHEMBL1194508 0.79 ALDH1A1 (0.51) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1
SCHEMBL1194379 0.78 HTR1A (0.50) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1
SCHEMBL1194268 0.78 FBP1 (0.50) CYP1A2CYP2D6CYP3A4CYP2C19MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796387-B2 Rubber composition BRIDGESTONE CORPORATION (JP) 2014-08-05 US disclosed
US-8609252-B2 Rubber composition BRIDGESTONE CORPORATION (JP) 2013-12-17 US disclosed
EP-2233521-B1 RUBBER COMPOSITION BRIDGESTONE CORP (JP) 2013-09-04 EP disclosed
EP-2316879-B1 RUBBER COMPOSITION BRIDGESTONE CORP (JP) 2013-08-07 EP disclosed
US-20110184109-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2011-07-28 US disclosed
US-20110172339-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2011-07-14 US disclosed
US-20110166277-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2011-07-07 US disclosed
US-20110124787-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2011-05-26 US disclosed
US-20110118397-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2011-05-19 US disclosed
EP-2316881-A1 RUBBER COMPOSITION Bridgestone Corporation (JP) 2011-05-04 EP disclosed
EP-2316880-A1 RUBBER COMPOSITION Bridgestone Corporation (JP) 2011-05-04 EP disclosed
EP-2316879-A1 RUBBER COMPOSITION Bridgestone Corporation (JP) 2011-05-04 EP disclosed
EP-2301997-A1 RUBBER COMPOSITION Bridgestone Corporation (JP) 2011-03-30 EP disclosed
EP-2298834-A1 RUBBER COMPOSITION Bridgestone Corporation (JP) 2011-03-23 EP disclosed
US-20110034638-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2011-02-10 US disclosed
EP-2233521-A1 RUBBER COMPOSITION Bridgestone Corporation (JP) 2010-09-29 EP disclosed