SCHEMBL7473772

SCHEMBL7473772

CN(C)CCCNC(=O)N1CCCCC1CCOCCCCCCCCCCCCCCCCCCNC=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32
F2 P00734 3/20 0.32
PRSS1 P07477 3/20 0.32
MAPK14 Q16539 1/20 0.32
PAOX Q6QHF9 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL7477702 0.89 DNM1 (0.41) HRH3POLBTSHRNPSR1
SCHEMBL7470756 0.80 HRH3 (0.40) HRH3LMNAKDM4EALDH1A1NPSR1
SCHEMBL7472666 0.80 ACHE (0.40)
Hydrochloric Acid SCHEMBL7478950 0.79 ACHE (0.39)
SCHEMBL7472660 0.79 DPP4 (0.35) NPSR1
SCHEMBL7473775 0.79 DNM1 (0.37) HRH3POLBTSHRNPSR1
Hydrochloric Acid SCHEMBL7478947 0.78 DPP4 (0.34) GNAI3GNAO1GNAI1NPSR1
SCHEMBL7473778 0.78 MEN1 (0.35)
SCHEMBL7475264 0.77 DNM1 (0.44) NPSR1
SCHEMBL7481710 0.77 MEN1 (0.36)

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