SCHEMBL8556347

SCHEMBL8556347

CCCCCCCCC1Cc2ccc(-c3ncc(-c4ccc(OCC(F)CCCCCC)cc4)cn3)cc2C1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.32
RARB P10826 3/20 0.31
CYP3A4 P08684 3/20 0.31
CYP2C8 P10632 2/20 0.31
S1PR3 Q99500 2/20 0.31
MCHR1 Q99705 1/20 0.30
CYP2D6 P10635 2/20 0.30
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30
OPRK1 P41145 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL8555728 0.93 CYP3A4 (0.32) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL8553224 0.86 NPC1 (0.45) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL8558587 0.81 FYN (0.36) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL10470566 0.80 RAB9A (0.53) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL10470518 0.80 RAB9A (0.53) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL9754258 0.80 RAB9A (0.53) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL10469762 0.80 RAB9A (0.53) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL10470188 0.80 RAB9A (0.53) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL10470615 0.80 RAB9A (0.53) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL10469832 0.80 RAB9A (0.53) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E

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
EP-0546338-B1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1998-02-04 EP disclosed
US-5385692-A Improved response CANON KABUSHIKI KAISHA (JP) 1995-01-31 US disclosed
EP-0546338-A1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1993-06-16 EP disclosed