SCHEMBL8964076

SCHEMBL8964076

CCCCCOc1ccc(-c2ccc(-c3ccc(C4=CCC(C5CCC(CCCCC)CC5)CC4)cc3F)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.32
CCNT1 O60563 1/20 0.30
CDK9 P50750 1/20 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
SCHEMBL8964221 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964276 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964007 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964251 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964257 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964109 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964052 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964248 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964070 0.99 RARB (0.32) PPARDCCNT1CDK9RARB
SCHEMBL8964057 0.98 CCNT1 (0.32) PPARDCCNT1CDK9

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