SCHEMBL7477516

SCHEMBL7477516

Cc1ccc(S(=O)(=O)OCCC2CCCCN2C(=O)N(C)CCCN2CCOCC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
TP53 P04637 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 3/20 0.40
GLA P06280 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RAB9A P51151 3/20 0.39
ATM Q13315 1/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HRH3 Q9Y5N1 1/20 0.39
NPC1 O15118 2/20 0.38

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
SCHEMBL7479965 0.87 POLB (0.38) ALDH1A1SMN1; SMN2HRH3
SCHEMBL7476087 0.85 MMP1 (0.39) MAPTALDH1A1HRH3
SCHEMBL7480507 0.79 MAPT (0.45) MAPTTP53MEN1KMT2AALDH1A1
SCHEMBL7484236 0.77 NPC1 (0.44) MAPTTP53MEN1KMT2AALDH1A1
SCHEMBL27031270 0.76 ALDH1A1 (0.44) ALDH1A1RAB9ANPC1
SCHEMBL7479744 0.76 MAPT (0.50) MAPTTP53MEN1KMT2AKDM4E
SCHEMBL7485723 0.76 FKBP1A (0.40) TP53ALDH1A1MAPK1NPSR1KDM4E
SCHEMBL7474734 0.74 CASP3 (0.41) GLAKDM4E
SCHEMBL2489249 0.74 HRH3 (0.56) MEN1KMT2AALDH1A1MAPK1RAB9A
SCHEMBL9068282 0.72 ALDH1A1 (0.48) MAPTTP53MEN1KMT2AALDH1A1

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