SCHEMBL17354072

SCHEMBL17354072

COc1ccc(CCSCCC[Si](OC)(OC)OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.45
TAAR1 Q96RJ0 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
F2RL1 P55085 1/20 0.42
MAOB P27338 2/20 0.41
POLB P06746 1/20 0.41
LTA4H P09960 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
IGF1R P08069 1/20 0.41
ALOX15 P16050 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
AOC3 Q16853 1/20 0.40

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
SCHEMBL17354078 0.87 PPARA (0.34) CALM1TAAR1KDM4EALDH1A1F2RL1
SCHEMBL17354073 0.87 CYP1A2 (0.47) ALDH1A1SMN1; SMN2TDP1L3MBTL1
SCHEMBL769798 0.86 CALM1 (0.44) CALM1TAAR1KDM4EALDH1A1F2RL1
SCHEMBL17354076 0.84 SMN1; SMN2 (0.43) TAAR1F2RL1POLBSMN1; SMN2
SCHEMBL6011833 0.84 TAAR1 (0.59) CALM1TAAR1KDM4EALDH1A1F2RL1
SCHEMBL16352360 0.84 ALDH1A1 (0.48) KDM4EALDH1A1SMN1; SMN2
SCHEMBL769794 0.83 CALM1 (0.45) CALM1TAAR1KDM4EALDH1A1F2RL1
SCHEMBL1585117 0.83 CALM1 (0.58) CALM1TAAR1ALDH1A1MAOBPOLB
SCHEMBL15806048 0.81 RCE1 (0.35) ALDH1A1
SCHEMBL13789483 0.80 ALPG (0.36) ALDH1A1F2RL1POLBSMN1; SMN2

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
US-9217921-B2 Resist underlayer film forming composition containing silicon having sulfide bond NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-22 US disclosed