SCHEMBL4650920

SCHEMBL4650920

CCCCc1ccccc1[S+](c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.41
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TLR8 Q9NR97 1/20 0.36
BID P55957 3/20 0.35
MCL1 Q07820 3/20 0.35
BCL2L1 Q07817 2/20 0.35
BAK1 Q16611 2/20 0.35
KAT8 Q9H7Z6 2/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
EP300 Q09472 1/20 0.35
KAT2A Q92830 1/20 0.35
KAT2B Q92831 1/20 0.35
KAT5 Q92993 1/20 0.35
SAE1 Q9UBE0 1/20 0.35
TYR P14679 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34

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
SCHEMBL4652036 0.93 LIPG (0.37) LIPGCYP3A4CYP2D6CYP2C9TLR8
SCHEMBL247026 0.93 LIPG (0.50) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL31005121 0.89 LIPG (0.50) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL3214972 0.89 LIPG (0.50) LIPGBIDMCL1BCL2L1BAK1
Acetic Acid SCHEMBL4378797 0.89 BID (0.38) LIPGBIDMCL1BCL2L1BAK1
SCHEMBL7528453 0.88 LIPG (0.46) LIPGCYP3A4CYP2D6CYP2C9TLR8
SCHEMBL4652042 0.84 CETP (0.36) LIPGCYP3A4CYP2D6CYP2C9BID
Trifluoromethanesulfonic Acid SCHEMBL5145136 0.84 KCNH2 (0.44) BIDMCL1BCL2L1BAK1
SCHEMBL3189054 0.82 GPR3 (0.39) CYSLTR2CYSLTR1
SCHEMBL3188722 0.81 LIPG (0.56) LIPGCYP3A4BIDMCL1BCL2L1

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-1804296-B1 LIGHT-RECEIVING DEVICE SUMITOMO BAKELITE CO (JP) 2008-10-01 EP disclosed
EP-1804296-A1 LIGHT-RECEIVING DEVICE SUMITOMO BAKELITE CO., LTD. (JP) 2007-07-04 EP disclosed