SCHEMBL14596332

SCHEMBL14596332

CC(C)CCC[C@H](C)CCOc1cnc(-c2ccc(O)cc2)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.43
ALOX5 P09917 1/20 0.43
RARB P10826 1/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MGAM O43451 2/20 0.39
GAA P10253 2/20 0.39
SI P14410 2/20 0.39
MGAM2 Q2M2H8 2/20 0.39
GGPS1 O95749 1/20 0.38
MAPK1 P28482 1/20 0.38
ESR1 P03372 1/20 0.37
XDH P47989 1/20 0.37
MAPT P10636 1/20 0.36
EGFR P00533 2/20 0.35

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
SCHEMBL14596742 1.00 FDPS (0.43) FDPSALOX5RARBNPC1RAB9A
SCHEMBL10476927 0.84 NPC1 (0.52) FDPSRARBNPC1RAB9ASMN1; SMN2
SCHEMBL14570027 0.84 NPC1 (0.52) FDPSRARBNPC1RAB9ASMN1; SMN2
SCHEMBL14570028 0.84 NPC1 (0.52) FDPSRARBNPC1RAB9ASMN1; SMN2
SCHEMBL10476928 0.84 NPC1 (0.52) FDPSRARBNPC1RAB9ASMN1; SMN2
SCHEMBL2050248 0.83 ALOX5 (0.55) FDPSALOX5RARBMGAMGAA
SCHEMBL9857946 0.80 NPC1 (0.45) RARBNPC1RAB9AMEN1KMT2A
SCHEMBL7546799 0.77 LMNA (0.42) FDPSALOX5RARBNPC1RAB9A
SCHEMBL10667656 0.76 NPC1 (0.56) RARBNPC1RAB9ASMN1; SMN2HSD17B10
SCHEMBL9723195 0.76 NPC1 (0.56) RARBNPC1RAB9ASMN1; SMN2HSD17B10

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-7195719-B1 High polarization ferroelectric liquid crystal compositions DISPLAYTECH, INC. (US) 2007-03-27 US disclosed