SCHEMBL10049321

SCHEMBL10049321

COc1ccc(CCC=C(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 2/20 0.50
TAAR1 Q96RJ0 1/20 0.50
F2RL1 P55085 1/20 0.47
MAOB P27338 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
ALOX15 P16050 2/20 0.45
IGF1R P08069 1/20 0.45
AOC3 Q16853 2/20 0.44
SIGMAR1 Q99720 1/20 0.44
GPR52 Q9Y2T5 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44
IDO1 P14902 1/20 0.44
MAPT P10636 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
SCHEMBL6053473 0.89 CALM1 (0.56) CALM1TAAR1F2RL1MAOBSMN1; SMN2
SCHEMBL3093124 0.83 TAAR1 (0.52) CALM1TAAR1F2RL1MAOBSMN1; SMN2
SCHEMBL11458753 0.81 CALM1 (0.50) CALM1TAAR1F2RL1MAOBSMN1; SMN2
SCHEMBL10049317 0.81 ALDH1A1 (0.57) CALM1TAAR1F2RL1MAOBSMN1; SMN2
SCHEMBL3085735 0.76 TAAR1 (0.57) CALM1TAAR1F2RL1MAOBSMN1; SMN2
SCHEMBL579009 0.76 SMN1; SMN2 (0.51) CALM1TAAR1F2RL1SMN1; SMN2GPR52
SCHEMBL445382 0.76 SMN1; SMN2 (0.51) CALM1TAAR1F2RL1SMN1; SMN2GPR52
SCHEMBL4948643 0.76 GPR52 (0.53) CALM1TAAR1F2RL1MAOBSMN1; SMN2
SCHEMBL3093198 0.75 TRPV1 (0.61) CALM1F2RL1ALOX15ALDH1A1CYP3A4
SCHEMBL806714 0.75 TRPV1 (0.61) CALM1F2RL1ALOX15ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148006-B2 Electrolytic solution and battery SONY CORPORATION (JP) 2012-04-03 US disclosed
US-8148006-B2 Electrolytic solution and battery SONY CORPORATION (JP) 2012-04-03 US disclosed
US-20080292970-A1 ELECTROLYTIC SOLUTION AND BATTERY SONY CORPORATION (JP) 2008-11-27 US disclosed
US-20080292970-A1 ELECTROLYTIC SOLUTION AND BATTERY SONY CORPORATION (JP) 2008-11-27 US disclosed