SCHEMBL9664419

SCHEMBL9664419

CCCCCc1ccc(-c2ccc(CCc3ccc(OC)cc3)cc2F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.56
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
IGF1R P08069 1/20 0.48
ALOX15 P16050 1/20 0.48
MAOB P27338 2/20 0.45
RARA P10276 1/20 0.44
RARG P13631 1/20 0.44
APP P05067 1/20 0.43
CYP2C19 P33261 1/20 0.43
S1PR1 P21453 2/20 0.43
S1PR3 Q99500 2/20 0.43
CALM1 P0DP23 1/20 0.42
HTR2A P28223 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTGS2 P35354 1/20 0.41
TUBB4A P04350 1/20 0.41

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
SCHEMBL9663445 1.00 RARB (0.56) RARBCASP3SENP8SENP7SENP6
SCHEMBL9663421 0.99 RARB (0.58) RARBCASP3SENP8SENP7SENP6
SCHEMBL9664275 0.99 RARB (0.58) RARBCASP3SENP8SENP7SENP6
SCHEMBL19721819 0.97 RARB (0.55) RARBCASP3SENP8SENP7SENP6
SCHEMBL9664946 0.96 RARB (0.51) RARBCASP3SENP8SENP7SENP6
SCHEMBL9665258 0.96 RARB (0.51) RARBCASP3SENP8SENP7SENP6
SCHEMBL21901394 0.93 RARB (0.50) RARBCASP3SENP8SENP7SENP6
SCHEMBL10379546 0.93 RARB (0.53) RARBCASP3SENP8SENP7SENP6
SCHEMBL17614877 0.92 RARB (0.56) RARBCASP3SENP8SENP7SENP6
SCHEMBL19722309 0.92 RARB (0.56) RARBCASP3SENP8SENP7SENP6

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-5093026-A Liquid crystals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-03-03 US disclosed