SCHEMBL28034758

SCHEMBL28034758

CCCCC(CCCCCCCCCCCCCCCCCOC(=O)CC)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.54
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HTT P42858 1/20 0.49
LMNA P02545 2/20 0.47
TSHR P16473 3/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL28171457 0.93 NAAA (0.47) NAAANPC1RAB9ASMN1; SMN2HTT
SCHEMBL1835591 0.89 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL1835557 0.89 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL1836691 0.89 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL1838451 0.89 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL1837368 0.87 NPC1 (0.50) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL1837371 0.87 SMN1; SMN2 (0.50) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL29012579 0.86 NPC1 (0.52) NAAANPC1RAB9ASMN1; SMN2LMNA
SCHEMBL1837804 0.86 NPC1 (0.54) NPC1RAB9ASMN1; SMN2LMNATSHR
SCHEMBL1835720 0.86 NPC1 (0.54) NPC1RAB9ASMN1; SMN2LMNATSHR

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-105111698-A Anti-aging plastic car instrument board and preparation method thereof NANTONG LIANHENG NEW MATERIAL CO LTD 2015-12-02 CN disclosed