SCHEMBL11070096

SCHEMBL11070096

CCCCCCc1ccc(-c2ccc(OCC)c(F)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.59
RARA P10276 2/20 0.59
RARG P13631 1/20 0.59
S1PR1 P21453 1/20 0.47
HSD17B10 Q99714 3/20 0.47
TSHR P16473 1/20 0.47
HTR2A P28223 1/20 0.46
ALDH1A1 P00352 4/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
MTOR P42345 1/20 0.46
RAB9A P51151 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 2/20 0.43
USP2 O75604 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
ESR1 P03372 2/20 0.42

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
SCHEMBL10977419 1.00 RARB (0.59) RARBRARARARGS1PR1HSD17B10
SCHEMBL10982640 1.00 RARB (0.59) RARBRARARARGS1PR1HSD17B10
SCHEMBL10978571 1.00 RARB (0.59) RARBRARARARGS1PR1HSD17B10
SCHEMBL10983282 1.00 RARB (0.59) RARBRARARARGS1PR1HSD17B10
SCHEMBL10974844 1.00 RARB (0.59) RARBRARARARGS1PR1HSD17B10
SCHEMBL10982386 1.00 RARB (0.59) RARBRARARARGS1PR1HSD17B10
SCHEMBL9512344 0.99 RARB (0.57) RARBRARARARGS1PR1HSD17B10
SCHEMBL9512933 0.99 RARB (0.57) RARBRARARARGS1PR1HSD17B10
SCHEMBL11067272 0.94 RARB (0.51) RARBRARARARGS1PR1HSD17B10
SCHEMBL9399694 0.91 RARB (0.59) RARBRARARARGS1PR1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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