SCHEMBL9019484

SCHEMBL9019484

C/C=C/C1CCC(C2CCC(c3ccc(-c4ccc(-c5ccc(O)c(F)c5F)cc4)c(F)c3F)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.34
FEN1 P39748 3/20 0.34

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
SCHEMBL15681341 0.91
SCHEMBL4561577 0.91
SCHEMBL9019627 0.90 CYP17A1 (0.33) ALOX5APFEN1
SCHEMBL13702091 0.87 NOTUM (0.31)
SCHEMBL15681309 0.87 NOTUM (0.31)
SCHEMBL8962440 0.87 ALOX5AP (0.31) ALOX5APFEN1
SCHEMBL9016060 0.86 CYP17A1 (0.34) ALOX5APFEN1
SCHEMBL13263292 0.86 WDR5 (0.31) ALOX5APFEN1
SCHEMBL15681399 0.85 HDAC2 (0.36)
SCHEMBL10165573 0.85

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