SCHEMBL7972190

SCHEMBL7972190

CC(=O)N(CCCc1c[nH]c2ccccc12)CCNCCNC(=O)CCc1c[nH]c2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
MTNR1A P48039 2/20 0.56
MAPT P10636 3/20 0.54
GFER P55789 1/20 0.54
ALDH1A1 P00352 3/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 2/20 0.51
LMNA P02545 1/20 0.51
PKM P14618 1/20 0.51
TSHR P16473 1/20 0.51
BLM P54132 1/20 0.51
GAA P10253 1/20 0.51
CYP2D6 P10635 1/20 0.50
HPGD P15428 1/20 0.50
RECQL P46063 1/20 0.50
MC5R P33032 1/20 0.49
KDM4E B2RXH2 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL7972523 0.85 MEN1 (0.81) MEN1KMT2AMTNR1AMAPTGFER
Acetic Acid SCHEMBL7972183 0.85 MAPT (0.66) MEN1KMT2AMTNR1AMAPTGFER
SCHEMBL7973988 0.85 MEN1 (0.71) MEN1KMT2AMTNR1AMAPTGFER
Hydrochloric Acid SCHEMBL7960692 0.84 MEN1 (0.79) MEN1KMT2AMTNR1AMAPTGFER
SCHEMBL7974250 0.79 MEN1 (0.77) MEN1KMT2AMTNR1AMAPTGFER
SCHEMBL7970577 0.78 MEN1 (0.68) MEN1KMT2AMTNR1AMAPTGFER
SCHEMBL24347579 0.78 MEN1 (0.68) MEN1KMT2AMTNR1AMAPTGFER
SCHEMBL7677886 0.78 MEN1 (0.84) MEN1KMT2AMTNR1AMAPTGFER
SCHEMBL27099044 0.77 MTNR1A (0.77) MEN1KMT2AMTNR1AMAPTGFER
SCHEMBL7849267 0.76 GFER (0.72) MEN1KMT2AMTNR1AMAPTGFER

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-2001055109-A1 AROMATIC AMIDES ACTING ON MELANOCORTIN RECEPTORS MELACURE THERAPEUTICS AB (SE) 2001-08-02 WO disclosed