SCHEMBL1419664

SCHEMBL1419664

CCC(C)N(Sc1nc2ccccc2s1)C(C)(C)CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.48
CYP1A2 P05177 3/20 0.46
CYP2D6 P10635 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C19 P33261 2/20 0.46
MAPK1 P28482 2/20 0.46
HIF1A Q16665 1/20 0.46
ALDH1A1 P00352 7/20 0.45
HPGD P15428 4/20 0.45
HSD17B10 Q99714 3/20 0.45
ADRA2A P08913 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
DRD2 P14416 1/20 0.45
ALOX15 P16050 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45
DRD1 P21728 1/20 0.45
MC5R P33032 1/20 0.45
OPRM1 P35372 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
SCHEMBL1419324 0.91 FBP1 (0.49) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL1194268 0.90 FBP1 (0.50) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL1193322 0.88 FBP1 (0.44) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL9702704 0.82 FBP1 (0.54) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL1419356 0.81 FBP1 (0.52) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL1419448 0.81 FBP1 (0.50) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL1419361 0.80 FBP1 (0.51) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL1194508 0.80 ALDH1A1 (0.51) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL1194511 0.79 FBP1 (0.45) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4
SCHEMBL1419086 0.78 FBP1 (0.49) FBP1CYP1A2CYP2D6L3MBTL1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102177200-B Rubber composition BRIDGESTONE CORP 2015-02-18 CN disclosed
US-8796387-B2 Rubber composition BRIDGESTONE CORPORATION (JP) 2014-08-05 US 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