SCHEMBL7479285

SCHEMBL7479285

CCCCCCCCCCCCCCCCCCOC(=O)N1CCCCC1CCOCCCCN(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GBA2 Q9HCG7 1/20 0.40
DNM1 Q05193 2/20 0.36
MAPT P10636 2/20 0.36
F2 P00734 4/20 0.36
PRSS1 P07477 4/20 0.36
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
NAAA Q02083 1/20 0.35
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 0.34
S1PR5 Q9H228 1/20 0.34
FKBP1A P62942 1/20 0.34
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL7482175 0.98 GBA2 (0.40) GBA2DNM1MAPTF2PRSS1
SCHEMBL7472878 0.87 GBA2 (0.38) GBA2DNM1MAPTNAAAS1PR1
SCHEMBL7474618 0.87 MEN1 (0.45) MAPT
SCHEMBL8174166 0.87 S1PR1 (0.37) MAPTF2PRSS1S1PR1S1PR3
SCHEMBL7478386 0.86 GBA2 (0.41) GBA2MAPTF2PRSS1S1PR1
SCHEMBL7483710 0.86 GBA2 (0.41) GBA2MAPTF2PRSS1S1PR1
SCHEMBL7474674 0.86 GBA2 (0.38) GBA2DNM1MAPTF2PRSS1
SCHEMBL7474984 0.86 DNM1 (0.50) GBA2DNM1MAPTPRSS1NAAA
SCHEMBL7470814 0.86 ACHE (0.44) DNM1
SCHEMBL7479855 0.85 NPC1 (0.44) MAPT

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 3 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
US-6057337-A USEFUL FOR CARE, IMPROVEMENT OR PREVENTION OF HAIR LOSS SHISEIDO CO., LTD. (JP) 2000-05-02 US disclosed
EP-0933361-A1 1,2-Di-substituted piperidine derivatives as hair growth promoter SHISEIDO COMPANY LIMITED (JP) 1999-08-04 EP disclosed