SCHEMBL8963980

SCHEMBL8963980

CCCCCC1CCC(C2CC=C(c3ccc(-c4ccc(-c5ccc(OCCC)c(F)c5F)cc4)c(F)c3)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 2/20 0.30
CDK9 P50750 2/20 0.30

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
SCHEMBL8964190 0.99 CCNT1 (0.30) CCNT1CDK9
SCHEMBL8964057 0.97 CCNT1 (0.32) CCNT1CDK9
SCHEMBL8964076 0.97 PPARD (0.32) CCNT1CDK9
SCHEMBL8964257 0.97 RARB (0.32) CCNT1CDK9
SCHEMBL8964109 0.97 RARB (0.32) CCNT1CDK9
SCHEMBL8964276 0.97 RARB (0.32) CCNT1CDK9
SCHEMBL8964052 0.97 RARB (0.32) CCNT1CDK9
SCHEMBL8964070 0.97 RARB (0.32) CCNT1CDK9
SCHEMBL8964251 0.97 RARB (0.32) CCNT1CDK9
SCHEMBL8964248 0.97 RARB (0.32) CCNT1CDK9

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
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed