SCHEMBL20006810

SCHEMBL20006810

CCCCc1ccc(C#Cc2cc(F)ccc2CCC)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.39
FFAR4 Q5NUL3 2/20 0.37
PTPN11 Q06124 1/20 0.37
PTPRO Q16827 1/20 0.37
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
CA1 P00915 1/20 0.34
CA2 P00918 1/20 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
SCHEMBL19999383 0.84 PTPN11 (0.38) FFAR1FFAR4PTPN11PTPROTSHR
SCHEMBL20006811 0.84 FFAR1 (0.48) FFAR1FFAR4PTPN11PTPROTSHR
SCHEMBL9416292 0.82 HSD17B10 (0.43) FFAR1FFAR4PTPN11PTPROTSHR
SCHEMBL7861098 0.82 HSD17B10 (0.40) FFAR1FFAR4PTPN11PTPROTSHR
SCHEMBL7850785 0.81 FFAR1 (0.47) FFAR1FFAR4PTPN11PTPROTSHR
SCHEMBL19384780 0.81 FFAR1 (0.45) FFAR1FFAR4PTPN11PTPROTSHR
SCHEMBL7858593 0.81 FFAR1 (0.42) FFAR1FFAR4PTPN11PTPRO
SCHEMBL7857762 0.81 FFAR1 (0.42) FFAR1FFAR4PTPN11PTPRO
SCHEMBL20004808 0.81 FFAR1 (0.39) FFAR1FFAR4PTPN11PTPROTSHR
SCHEMBL20006812 0.81 FFAR1 (0.47) FFAR1FFAR4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10208249-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-02-19 US disclosed
US-20180086979-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-03-29 US disclosed