SCHEMBL9406733

SCHEMBL9406733

CCOc1ccc(CCc2ccc(-c3ccc(CC)cc3)cc2)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.41
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
CALM1 P0DP23 2/20 0.36
MAPK1 P28482 2/20 0.35
FGFR2 P21802 1/20 0.34
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
FAAH O00519 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL20346149 0.95 FFAR4 (0.43) FFAR4CALM1MAPK1TAAR1L3MBTL1
SCHEMBL12740090 0.92 FFAR4 (0.39) FFAR4CALM1MAPK1FGFR2S1PR1
SCHEMBL12717240 0.92 FFAR4 (0.39) FFAR4CALM1MAPK1FGFR2S1PR1
SCHEMBL9406154 0.91 GABRA1 (0.40) FFAR4RXRARXRBRXRGCALM1
SCHEMBL20346156 0.89 S1PR1 (0.39) FFAR4MAPK1S1PR1L3MBTL1KMT2A
SCHEMBL9406582 0.88 RARB (0.41) RXRARXRBRXRGMAPK1L3MBTL1
SCHEMBL20346157 0.88 CYP19A1 (0.39) FFAR4CALM1GABRA1GABRB2
SCHEMBL9405882 0.87 MAPT (0.43) L3MBTL1KMT2AKDM4EMEN1ALDH1A1
SCHEMBL1243473 0.87 FFAR4 (0.40) FFAR4RXRARXRBRXRGCALM1
SCHEMBL10301919 0.86 FFAR4 (0.40) FFAR4RXRARXRBRXRGCALM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180187079-A1 COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-07-05 US disclosed
US-20180187079-A1 COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-07-05 US disclosed
US-5279764-A Dihalogenobenzene derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-01-18 US disclosed