SCHEMBL13586355

SCHEMBL13586355

C=CC1CCC(c2ccc(-c3ccc(/C=C/c4ccc(C5CO5)c(F)c4)cc3)c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.32

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
SCHEMBL13586283 0.88
SCHEMBL9016002 0.88 ALOX5AP (0.33)
SCHEMBL13586279 0.88 BRD4 (0.31) BRD4
SCHEMBL9015723 0.86 BRD4 (0.30) BRD4
SCHEMBL12822706 0.85 NFE2L2 (0.31)
SCHEMBL13586278 0.84 BRD4 (0.33) BRD4
SCHEMBL13586344 0.84 ALOX5AP (0.32) BRD4
SCHEMBL12822384 0.84 BRD4 (0.36) BRD4
SCHEMBL9018782 0.84 ALOX5AP (0.31)
SCHEMBL12823704 0.84 BRD4 (0.33) BRD4

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
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 WO disclosed