SCHEMBL7474633

SCHEMBL7474633

CCCCCCCCCCCCCCCCCCNC(=O)N1CCCCC1CCON(C=O)CCCN1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
ALDH1A1 P00352 2/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
EPHX1 P07099 1/20 0.37
GAA P10253 1/20 0.37
EPHX2 P34913 2/20 0.36
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
NAMPT P43490 1/20 0.36
KDM4E B2RXH2 1/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
PAOX Q6QHF9 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
Hydrochloric Acid SCHEMBL7472629 0.99 MAPT (0.44) MAPTALDH1A1CYP3A4CYP2C9HPGD
SCHEMBL7484182 0.94 MAPT (0.45) MAPTALDH1A1CYP3A4CYP2C9HPGD
SCHEMBL7471608 0.91 KDM4E (0.39) MAPTGNAI3GNAO1GNAI1KDM4E
SCHEMBL8175563 0.91 GNAI3 (0.38) MAPTGAAGNAI3GNAO1GNAI1
SCHEMBL7484144 0.90 KDM4E (0.41) MAPTALDH1A1GNAI3GNAO1GNAI1
SCHEMBL7474801 0.87 MAPT (0.47) MAPTCYP2C9CYP2C19
SCHEMBL7475727 0.87 MAPT (0.42) MAPTCYP2C9CYP2C19
Hydrochloric Acid SCHEMBL7480495 0.86 MAPT (0.46) MAPTCYP2C9CYP2C19
SCHEMBL7472660 0.86 DPP4 (0.35) EPHX1EPHX2
SCHEMBL7477978 0.86 GNAI3 (0.36) MAPTEPHX1GNAI3GNAO1GNAI1

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