SCHEMBL7478647

SCHEMBL7478647

NC(=O)N1CCCCC1CCn1cccc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.43
AKR1C3 P42330 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 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
SCHEMBL7478645 0.81 TP53 (0.53) TP53POLB
SCHEMBL3762079 0.80 TP53 (0.56) TP53POLB
Hydrochloric Acid SCHEMBL31186624 0.78 TP53 (0.54) TP53POLB
SCHEMBL8365982 0.77 AKR1C3 (0.46) TP53AKR1C3POLBHCRTR1HCRTR2
SCHEMBL3345264 0.76 POLB (0.39) TP53POLB
SCHEMBL1651679 0.76 POLB (0.39) TP53POLB
SCHEMBL6970610 0.74 MEN1 (0.54)
SCHEMBL14941549 0.73 L3MBTL1 (0.62) POLB
SCHEMBL4780628 0.73 S1PR1 (0.43) TP53CYP2C19
SCHEMBL8602693 0.73 S1PR1 (0.43) TP53CYP2C19

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 1 patent. 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