SCHEMBL21609902

SCHEMBL21609902

CCOc1ccc(-c2ccc(-c3ccccc3)cc2F)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
HSD17B10 Q99714 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SLC6A9 P48067 1/20 0.42
FGFR2 P21802 2/20 0.41
FGFR1 P11362 1/20 0.41
MAPT P10636 2/20 0.41
FAAH O00519 1/20 0.41
PTPRC P08575 1/20 0.40
FFAR1 O14842 2/20 0.40
PPARD Q03181 2/20 0.40
NAAA Q02083 1/20 0.40
PTGS2 P35354 2/20 0.40
PTGS1 P23219 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL21609904 0.88 FGFR2 (0.44) KDM4EHSD17B10NPC1RAB9AFGFR2
SCHEMBL20010658 0.88 FGFR2 (0.41) KDM4EHSD17B10FGFR2FGFR1MAPT
SCHEMBL17108434 0.87 FGFR2 (0.41) KDM4EHSD17B10FGFR2FGFR1MAPT
SCHEMBL20097219 0.86 FGFR2 (0.43) KDM4EHSD17B10NPC1RAB9AFGFR2
SCHEMBL20015625 0.85 GABRA1 (0.40) KDM4EHSD17B10NPC1RAB9AFGFR2
SCHEMBL21609908 0.84 ADORA1 (0.44) KDM4EHSD17B10NPC1RAB9AFGFR2
SCHEMBL15256185 0.82 L3MBTL1 (0.43) KDM4EHSD17B10NPC1RAB9AFGFR2
SCHEMBL16855917 0.80 FGFR2 (0.46) KDM4EHSD17B10FGFR2FGFR1MAPT
SCHEMBL8932603 0.79 TAAR1 (0.45) KDM4EHSD17B10FGFR2FGFR1MAPT
SCHEMBL19308568 0.79 DHODH (0.43) NPC1RAB9AMAPTPTGS2PTGS1

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-10519377-B1 Liquid crystal composition of negative monomer containing cyclopentyl cyclohexenyl and liquid crystal display element or liquid crystal display thereof Shijiazhuang Chengzhi Yonghua Display Material Co., Ltd (CN) 2019-12-31 US disclosed