SCHEMBL7484182

SCHEMBL7484182

CCCCCCCCCCCCCCCCCCN(C=O)OCCC1CCCCN1C(=O)NCCN1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
MMP3 P08254 1/20 0.37
CYP2C9 P11712 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
TSHR P16473 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
TLR2 O60603 1/20 0.34
NAMPT P43490 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
SCHEMBL7474633 0.94 MAPT (0.45) MAPTCYP2C9KDM4EALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL7472629 0.93 MAPT (0.44) MAPTCYP2C9KDM4EALDH1A1CYP3A4
SCHEMBL7471608 0.89 KDM4E (0.39) MAPTKDM4ETP53
SCHEMBL7484144 0.87 KDM4E (0.41) MAPTKDM4EALDH1A1TP53
SCHEMBL7473775 0.85 DNM1 (0.37) TSHR
SCHEMBL8175563 0.85 GNAI3 (0.38) MAPTKDM4ETP53
SCHEMBL7475727 0.85 MAPT (0.42) MAPTMMP3CYP2C9TP53CYP2C19
SCHEMBL7474801 0.84 MAPT (0.47) MAPTCYP2C9TP53CYP2C19
SCHEMBL7479745 0.84 DPP4 (0.34)
Hydrochloric Acid SCHEMBL7480495 0.84 MAPT (0.46) MAPTCYP2C9TP53CYP2C19

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