SCHEMBL15529787

SCHEMBL15529787

CCC[Sn](c1cc(C)ccc1C)(c1cc(C)ccc1C)c1cc(C)ccc1C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.37
ALDH1A1 P00352 2/20 0.37
TAAR1 Q96RJ0 1/20 0.35
TP53 P04637 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2A6 P11509 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RAPGEF4 Q8WZA2 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL15529503 0.88 ALDH1A1 (0.34) TDP1ALDH1A1TAAR1TP53CYP1A2
SCHEMBL15529423 0.86 TLR8 (0.36) TDP1ALDH1A1TAAR1TP53KDM4E
SCHEMBL15530222 0.85 CNR2 (0.38) TDP1ALDH1A1TAAR1TP53KDM4E
SCHEMBL15529680 0.85 CNR2 (0.38) TDP1ALDH1A1TAAR1TP53KDM4E
SCHEMBL15529494 0.85 CNR2 (0.38) TDP1ALDH1A1TAAR1TP53KDM4E
SCHEMBL15529745 0.83 TDP1 (0.39) TDP1ALDH1A1TAAR1TP53CYP1A2
SCHEMBL15529220 0.79 ALDH1A1 (0.33) TDP1ALDH1A1TAAR1
SCHEMBL1453413 0.76 TLR8 (0.36) TDP1ALDH1A1TAAR1TP53CYP1A2
SCHEMBL15530127 0.73 ALDH1A1 (0.35) TDP1ALDH1A1TAAR1TP53CYP1A2
SCHEMBL1028129 0.72 TDP1 (0.46) TDP1ALDH1A1TAAR1TP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013167585-A2 RECYCLING OF ORGANOTIN COMPOUNDS UNIVERSITEIT ANTWERPEN (BE) 2013-11-14 WO disclosed