SCHEMBL19829193

SCHEMBL19829193

CCCC1CCC(c2ccc(C(F)(F)Oc3ccc(-c4ccc(OCF)c(F)c4)c(F)c3)c(F)c2)OC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
PIM1 P11309 1/20 0.30
PIM2 Q9P1W9 1/20 0.30
GRM2 Q14416 1/20 0.30
FASN P49327 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
SCHEMBL18310582 0.90 FASN (0.35) ALOX5APFEN1PIM1PIM2GRM2
SCHEMBL19829175 0.89 ALOX5AP (0.32) ALOX5APFEN1PIM1PIM2GRM2
SCHEMBL19829239 0.88
SCHEMBL18310579 0.88
SCHEMBL19829214 0.88 KDM1A (0.32)
SCHEMBL15461190 0.83 FASN (0.32) FASN
SCHEMBL19829237 0.82 GRM2 (0.32) ALOX5APFEN1PIM1PIM2GRM2
SCHEMBL19829236 0.82 ALOX5AP (0.32) ALOX5APFEN1PIM1PIM2GRM2
SCHEMBL18310585 0.82 FFAR1 (0.32)
SCHEMBL18310384 0.81 KDM1A (0.42) FASN

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-20180030351-A1 LIQUID CRYSTAL COMPOUND HAVING POLYFLUORO-2-BUTENOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-02-01 US disclosed