SCHEMBL1194040

SCHEMBL1194040

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.47
HTR2A P28223 1/20 0.47
HTR7 P34969 1/20 0.47
FBP1 P09467 2/20 0.47
ALDH1A1 P00352 7/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 3/20 0.44
CYP2D6 P10635 3/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44
MAPK1 P28482 1/20 0.44
HIF1A Q16665 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HPGD P15428 3/20 0.44
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GFER P55789 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44

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
SCHEMBL1193907 0.88 HTR1A (0.50) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL1193644 0.82 FBP1 (0.49) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL1193945 0.82 HTR1A (0.55) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL1194142 0.81 HTR1A (0.48) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL1194379 0.81 HTR1A (0.50) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL1194289 0.79 ALDH1A1 (0.46) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL1194268 0.78 FBP1 (0.50) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL12086023 0.76 FBP1 (0.48) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL1419664 0.76 FBP1 (0.48) HTR1AHTR2AHTR7FBP1ALDH1A1
SCHEMBL29494838 0.75 FBP1 (0.59) HTR1AHTR2AHTR7FBP1ALDH1A1

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