SCHEMBL9225288

SCHEMBL9225288

CCCCCCCc1ccc(-c2ccc(-c3ccc(OC(F)F)c(F)c3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.56
RARA P10276 2/20 0.56
RARG P13631 1/20 0.56
HSD17B10 Q99714 2/20 0.44
TSHR P16473 1/20 0.44
HTR2A P28223 1/20 0.44
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
MTOR P42345 1/20 0.43
KMT2A Q03164 1/20 0.43
MGLL Q99685 3/20 0.42
S1PR1 P21453 1/20 0.41
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 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
SCHEMBL9221186 1.00 RARB (0.56) RARBRARARARGHSD17B10TSHR
SCHEMBL9227843 0.99 RARB (0.54) RARBRARARARGHSD17B10TSHR
SCHEMBL9221848 0.94 RARB (0.49) RARBRARARARGHSD17B10TSHR
SCHEMBL9229326 0.94 RARB (0.51) RARBRARARARGHSD17B10TSHR
SCHEMBL9226334 0.94 RARB (0.51) RARBRARARARGHSD17B10TSHR
SCHEMBL9223491 0.92 RARB (0.49) RARBRARARARGHSD17B10TSHR
SCHEMBL9221500 0.92 RARB (0.55) RARBRARARARGHSD17B10TSHR
SCHEMBL9225240 0.92 RARB (0.55) RARBRARARARGHSD17B10TSHR
SCHEMBL6060307 0.91 RARB (0.48) RARBRARARARGHSD17B10TSHR
SCHEMBL6059342 0.91 RARB (0.48) RARBRARARARGHSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413785-B1 LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS MERCK PATENT GMBH (DE) 1995-12-20 EP disclosed
EP-0413785-A1 LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS. MERCK PATENT GMBH (DE) 1991-02-27 EP disclosed
WO-1990009420-A1 LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1990-08-23 WO disclosed