SCHEMBL8511734

SCHEMBL8511734

COc1cc(OC)c2nc(SNC(C)(C)CC(C)(C)C)sc2c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 3/20 0.40
PDK1 Q15118 1/20 0.35
PPARA Q07869 1/20 0.33
MAPT P10636 3/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CSF1R P07333 5/20 0.32
CREBBP Q92793 1/20 0.32
PDGFRB P09619 2/20 0.32
KIT P10721 2/20 0.32
PDGFRA P16234 2/20 0.32
IDO1 P14902 1/20 0.31
FLT3 P36888 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PKM P14618 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL8510596 0.89 F2RL3 (0.41) F2RL3PDK1PPARAMAPTLMNA
SCHEMBL8513176 0.86 F2RL3 (0.39) F2RL3PDK1PPARAMAPTLMNA
SCHEMBL8511853 0.86 F2RL3 (0.39) F2RL3PDK1PPARAMAPK1NPC1
SCHEMBL8511842 0.79 F2RL3 (0.39) F2RL3PDK1PPARANPC1
SCHEMBL8511932 0.73 F2RL3 (0.40) F2RL3PDK1MAPTLMNAMAPK1
SCHEMBL8510074 0.73 F2RL3 (0.40) F2RL3PDK1PPARAMAPTMAPK1
SCHEMBL8513065 0.73 F2RL3 (0.40) F2RL3PDK1PPARAMAPTLMNA
SCHEMBL1821962 0.72 F2RL3 (0.43) F2RL3PDK1PPARAMAPTCSF1R
SCHEMBL1820930 0.72 F2RL3 (0.41) F2RL3PDK1PPARAMAPTLMNA
SCHEMBL8513075 0.71 ALDH1A1 (0.43) MAPTLMNAMAPK1L3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2439236-B1 RUBBER COMPOSITION BRIDGESTONE CORP (JP) 2014-10-01 EP disclosed
US-20120136102-A1 RUBBER COMPOSITION BRIDGESTONE CORPORATION (JP) 2012-05-31 US disclosed