SCHEMBL28042425

SCHEMBL28042425

CCCCCCCCCCCCCCC(OCCC)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
SLC7A5 Q01650 2/20 0.40
KCNH2 Q12809 1/20 0.40
SLC2A1 P11166 1/20 0.40
CSNK1E P49674 1/20 0.40
ALDH1A1 P00352 2/20 0.39
ASAH1 Q13510 1/20 0.39
ACER2 Q5QJU3 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
OPRL1 P41146 1/20 0.39
NAAA Q02083 2/20 0.39
POLB P06746 1/20 0.39
CASR P41180 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
LTA4H P09960 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
SCHEMBL28042231 0.98 SLC7A5 (0.41) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28042429 0.93 NPC1 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28042430 0.93 SLC7A5 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28042226 0.93 NPC1 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28106834 0.93 NPC1 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28042424 0.93 NPC1 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28042227 0.93 NPC1 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28042428 0.93 NPC1 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28042426 0.93 NPC1 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5
SCHEMBL28042470 0.93 NPC1 (0.43) HTR2ANPC1RAB9ASMN1; SMN2SLC7A5

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
CN-105143305-A Polycarbonate resin for liquid crystal member, polycarbonate resin composition for liquid crystal member containing the same, and liquid crystal member IDEMITSU KOSAN CO 2015-12-09 CN disclosed