SCHEMBL28042430

SCHEMBL28042430

CCCCCCCCCCCCCCC(OCCCC)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.43
SLC2A1 P11166 1/20 0.43
LTA4H P09960 2/20 0.42
HTR2A P28223 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNH2 Q12809 1/20 0.40
CSNK1E P49674 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 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
CASR P41180 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
SCHEMBL28042230 0.98 SLC7A5 (0.44) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28042470 0.97 NPC1 (0.43) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28042428 0.97 NPC1 (0.43) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28042226 0.97 NPC1 (0.43) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28042227 0.97 NPC1 (0.43) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28106834 0.97 NPC1 (0.43) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28042429 0.97 NPC1 (0.43) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28042424 0.97 NPC1 (0.43) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28042426 0.97 NPC1 (0.43) SLC7A5SLC2A1LTA4HHTR2ANPC1
SCHEMBL28042427 0.95 LTA4H (0.43) SLC7A5LTA4HHTR2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106133058-A Polycarbonate resin composition and molded article 出光兴产株式会社 2016-11-16 CN disclosed
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