SCHEMBL4697732

SCHEMBL4697732

CS(=O)(=O)N(CCN1C(=O)c2ccccc2C1=O)c1ccccc1C1(C(=O)[C@H](N)Cc2ccc(Cl)cc2)CCNCC1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MC4R P32245 4/20 0.36
TDP1 Q9NUW8 1/20 0.34
MMP2 P08253 4/20 0.34
MMP9 P14780 4/20 0.34

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 SCHEMBL4702657 0.99 MC4R (0.36) MC4RTDP1MMP2MMP9
SCHEMBL4697730 0.74 MC4R (0.44) MC4R
Hydrochloric Acid SCHEMBL4676307 0.74 MC4R (0.43) MC4R
SCHEMBL4702527 0.66 MAOB (0.38)
Hydrochloric Acid SCHEMBL4698894 0.65 HTR2C (0.39)
SCHEMBL5478550 0.62 MC4R (0.59) MC4R
SCHEMBL4700176 0.60 MAPK1 (0.45) TDP1
SCHEMBL12346685 0.60 MEN1 (0.42) TDP1
SCHEMBL1529828 0.58 SLC6A4 (0.53) TDP1MMP2MMP9
SCHEMBL1529830 0.58 SLC6A4 (0.53) TDP1MMP2MMP9

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-1416933-B1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM INC (US) 2008-01-02 EP disclosed