SCHEMBL22339735

SCHEMBL22339735

CCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(N)=O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PSMB5 P28074 1/20 0.42
CYP2C9 P11712 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
GAA P10253 1/20 0.31
RECQL P46063 2/20 0.31
CTSD P07339 1/20 0.31
MAOA P21397 2/20 0.30
MAOB P27338 2/20 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
SCHEMBL2891874 0.95
SCHEMBL20880632 0.81 F2 (0.38) RECQLMAOAMAOB
SCHEMBL22199552 0.81 CA1 (0.40) CA1CA2RECQLMAOAMAOB
SCHEMBL20960533 0.80 KMT2A (0.50) MEN1KMT2APSMB5CYP2C9GAA
SCHEMBL16802010 0.80 KMT2A (0.50) MEN1KMT2APSMB5CYP2C9GAA
SCHEMBL18515920 0.80 PSMB5 (0.46) MEN1KMT2APSMB5
SCHEMBL23471380 0.78 MEN1 (0.48) MEN1KMT2APSMB5RECQL
SCHEMBL23289286 0.78 MEN1 (0.48) MEN1KMT2APSMB5CYP2C9GAA
SCHEMBL18804442 0.78 TERT (0.40) CA1CA2MAOAMAOB
SCHEMBL23417923 0.78 TERT (0.40) CA1CA2MAOAMAOB

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
WO-2020161255-A1 NOVEL METHOD FOR REDUCING HAIR GROWTH DSM IP ASSETS B.V. (NL) 2020-08-13 WO disclosed