SCHEMBL9631468

SCHEMBL9631468

CCCCC1CCC(C(C)c2ccc(-c3ccc(CCC)cc3)c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
MPL P40238 4/20 0.32
FFAR4 Q5NUL3 5/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL9630243 0.97 RARB (0.33) RARBMAOAMAOBMPLFFAR4
SCHEMBL9632665 0.96 RARB (0.35) RARBMAOAMAOBMPLFFAR4
SCHEMBL9630433 0.94 RARB (0.38) RARBMPLHRH3
SCHEMBL9630554 0.93 MAOA (0.33) MAOAMAOBMPLFFAR4
SCHEMBL9631304 0.92 RARB (0.38) RARBMPLHRH3
SCHEMBL9632544 0.91 RARB (0.39) RARB
SCHEMBL9630364 0.91 RARB (0.39) RARB
SCHEMBL9630345 0.91 RARB (0.39) RARB
SCHEMBL9631056 0.91 RARB (0.39) RARB
SCHEMBL9631641 0.90 RARB (0.38) RARBMPLHRH3

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
EP-0364538-B1 DIFLUOROBENZOL DERIVATIVES MERCK PATENT GmbH (DE) 1992-05-06 EP disclosed