SCHEMBL7476087

SCHEMBL7476087

CCCCCCCCCCCCCCCCCCN(C)C(=O)N1CCCCC1CCOS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.39
MMP3 P08254 2/20 0.39
MMP7 P09237 2/20 0.39
MMP9 P14780 2/20 0.39
MMP13 P45452 2/20 0.39
LMNA P02545 1/20 0.38
MCHR1 Q99705 1/20 0.37
MAPT P10636 1/20 0.37
ADRB2 P07550 2/20 0.37
ADRB1 P08588 2/20 0.37
ADRB3 P13945 2/20 0.37
POLB P06746 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CASP3 P42574 1/20 0.36
CASP7 P55210 1/20 0.36
KCNH2 Q12809 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
FKBP1A P62942 1/20 0.35

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 0.91 POLB (0.38) POLBALDH1A1CASP3CASP7KCNH2
SCHEMBL7477516 0.85 MAPT (0.45) MAPTALDH1A1HRH3
SCHEMBL7481690 0.85 NPC1 (0.47) MAPT
SCHEMBL7477251 0.84 FKBP1A (0.42) LMNAMAPTPOLBALDH1A1CASP3
SCHEMBL7484236 0.80 NPC1 (0.44) MAPTPOLBALDH1A1CASP3CASP7
SCHEMBL27031270 0.80 ALDH1A1 (0.44) POLBALDH1A1CASP3CASP7FKBP1A
SCHEMBL7485723 0.79 FKBP1A (0.40) POLBALDH1A1CASP3CASP7FKBP1A
SCHEMBL7477416 0.78 S1PR1 (0.47) CASP3CASP7
SCHEMBL9068282 0.78 ALDH1A1 (0.48) LMNAMAPTPOLBALDH1A1CASP3
SCHEMBL9068477 0.78 ALDH1A1 (0.48) LMNAMAPTPOLBALDH1A1CASP3

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