SCHEMBL8964229

SCHEMBL8964229

CCCCCCCC1CCC(C2CC=C(c3ccc(-c4ccc(-c5ccc(OC)c(F)c5F)cc4)c(F)c3)CC2)CC1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
CCNT1 O60563 3/20 0.30
CDK9 P50750 3/20 0.30
RARB P10826 1/20 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
SCHEMBL8963962 0.99 CCNT1 (0.31) CCNT1CDK9
SCHEMBL8965887 0.94 MGLL (0.33) MGLLCNR1CNR2CCNT1CDK9
SCHEMBL8965677 0.93 NAAA (0.32) MGLLCCNT1CDK9
SCHEMBL8964186 0.93 RARB (0.30) RARB
SCHEMBL8963542 0.93 CCNT1 (0.32) CCNT1CDK9
SCHEMBL8964257 0.92 RARB (0.32) CCNT1CDK9RARB
SCHEMBL8964052 0.92 RARB (0.32) CCNT1CDK9RARB
SCHEMBL8964070 0.92 RARB (0.32) CCNT1CDK9RARB
SCHEMBL8964251 0.92 RARB (0.32) CCNT1CDK9RARB
SCHEMBL8964276 0.92 RARB (0.32) CCNT1CDK9RARB

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