SCHEMBL7478386

SCHEMBL7478386

CCCCCCCCCCCCCCCCCCOCCC1CCCCN1C(=O)OCCCCl

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GBA2 Q9HCG7 1/20 0.41
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.36
S1PR5 Q9H228 4/20 0.36
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
NPC1 O15118 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
HCRTR1 O43613 1/20 0.35
FKBP1A P62942 1/20 0.35
F2 P00734 1/20 0.35
PRSS1 P07477 1/20 0.35
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
S1PR4 O95977 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL7483710 0.98 GBA2 (0.41) GBA2MAPTTP53S1PR5S1PR1
SCHEMBL7482175 0.86 GBA2 (0.40) GBA2MAPTS1PR5S1PR1S1PR3
SCHEMBL7479285 0.86 GBA2 (0.40) GBA2MAPTS1PR5S1PR1S1PR3
SCHEMBL7473874 0.85 NPC1 (0.48) MAPTTP53NPC1HPGDRAB9A
SCHEMBL7475380 0.84 GBA2 (0.48) GBA2MAPTS1PR5S1PR1S1PR3
SCHEMBL7474658 0.84 NPC1 (0.47) MAPTTP53NPC1HPGDRAB9A
SCHEMBL7480867 0.82 NPSR1 (0.40) MAPTNPSR1EPHX2
SCHEMBL10612338 0.81 GBA2 (0.53) GBA2MAPTS1PR5S1PR1S1PR3
SCHEMBL9761016 0.80 MAPT (0.43) GBA2MAPTTP53S1PR5S1PR1
SCHEMBL7479247 0.80 MAPT (0.37) MAPTTP53S1PR5S1PR1S1PR3

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
EP-0933361-B1 1,2-Di-substituted piperidine derivatives as hair growth promoter SHISEIDO CO LTD (JP) 2002-03-27 EP disclosed
EP-0933361-A1 1,2-Di-substituted piperidine derivatives as hair growth promoter SHISEIDO COMPANY LIMITED (JP) 1999-08-04 EP disclosed