SCHEMBL10975282

SCHEMBL10975282

CCCCCCCc1ccc(-c2ccc(OCCCCC)c(F)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.59
RARA P10276 2/20 0.59
RARG P13631 1/20 0.59
S1PR1 P21453 2/20 0.52
PTPN11 Q06124 2/20 0.50
PTPN1 P18031 1/20 0.50
PTPN6 P29350 1/20 0.50
S1PR2 O95136 1/20 0.48
S1PR3 Q99500 1/20 0.48
LPAR2 Q9HBW0 1/20 0.48
HSD17B10 Q99714 2/20 0.47
TSHR P16473 1/20 0.47
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
HTR2A P28223 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
MTOR P42345 1/20 0.46

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
SCHEMBL11059845 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL10975079 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL10983916 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL10986242 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL10978712 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL10979911 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL10979316 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL10986195 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL10979446 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11
SCHEMBL9399745 1.00 RARB (0.59) RARBRARARARGS1PR1PTPN11

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-0074608-B1 LIQUID CRYSTAL HALOGEN COMPOUNDS, PROCESS FOR THEIR PREPARATION, DIELECTRIC AND DECTROOPTICAL DISPLAY ELEMENT CONTAINING THEM MERCK PATENT GmbH (DE) 1985-07-03 EP disclosed
US-4490305-A Liquid-crystalline halogen compounds, process for their preparation, dielectrics containing these, and electro-optical display element MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-12-25 US disclosed
EP-0074608-A2 Liquid crystal halogen compounds, process for their preparation, dielectric and dectrooptical display element containing them MERCK PATENT GmbH (DE) 1983-03-23 EP disclosed