SCHEMBL7477406

SCHEMBL7477406

CC(=O)NC1CCNC(CCO)C1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.42
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TLR4 O00206 1/20 0.37
OGA O60502 1/20 0.34
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
EPHX1 P07099 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
DRD2 P14416 1/20 0.30

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
SCHEMBL27654826 0.74 ATM (0.48) ATMALDH1A1KDM4ETLR4OGA
SCHEMBL8086087 0.74 POLB (0.47) ATMMTNR1AMTNR1B
SCHEMBL7464313 0.72 LMNA (0.43) EPHX1MEN1KMT2A
SCHEMBL7619156 0.72 LMNA (0.43) EPHX1MEN1KMT2A
SCHEMBL27077256 0.71 EPHX1 (0.34) ATMEPHX1MEN1KMT2A
SCHEMBL6026414 0.71 SIGMAR1 (0.36) ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL7454269 0.71 LMNA (0.43) EPHX1MEN1KMT2A
SCHEMBL7476219 0.71 CHRM2 (0.31)
SCHEMBL7474652 0.70 CHRNB2 (0.33)
SCHEMBL6906842 0.69 TSHR (0.42) ALDH1A1MEN1KMT2A

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