SCHEMBL9356266

SCHEMBL9356266

NC(=O)[C@H]1C[C@@H](C(=O)NCc2ccccc2)N1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MC4R P32245 2/20 0.56
HPGD P15428 2/20 0.53
USP2 O75604 1/20 0.53
ALDH1A1 P00352 1/20 0.53
CACNA1G O43497 6/20 0.52
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
F2 P00734 1/20 0.48
DPP4 P27487 1/20 0.47
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL9356279 1.00 MC4R (0.56) MC4RHPGDUSP2ALDH1A1CACNA1G
SCHEMBL9356274 1.00 MC4R (0.56) MC4RHPGDUSP2ALDH1A1CACNA1G
SCHEMBL6685347 0.83 MC4R (0.58) MC4RHPGDUSP2ALDH1A1CACNA1G
SCHEMBL172539 0.83 MC4R (0.58) MC4RHPGDUSP2ALDH1A1CACNA1G
SCHEMBL30254694 0.81 MC4R (0.55) MC4RHPGDUSP2ALDH1A1CACNA1G
Hydrochloric Acid SCHEMBL15142852 0.79 MC4R (0.54) MC4RHPGDUSP2ALDH1A1CACNA1G
SCHEMBL19234012 0.77 MC4R (0.57) MC4RHPGDUSP2ALDH1A1CACNA1G
SCHEMBL15149552 0.76 HPGD (0.56) MC4RHPGDUSP2ALDH1A1CACNA1G
SCHEMBL19476409 0.76 HPGD (0.56) MC4RHPGDUSP2ALDH1A1CACNA1G
SCHEMBL30239976 0.75 MC4R (0.74) MC4RHPGDUSP2ALDH1A1TSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0299513-B1 Azetidine derivatives, compositions and their use FIDIA GEORGETOWN INST (US) 1994-10-05 EP disclosed
US-4990504-A Modulate excitatory amino acid receptor system FIDIA-GEORGETOWN INSTITUTE FOR THE NEUROSCIENCES (US) 1991-02-05 US disclosed
US-4946839-A ALZHEIMER'S DISEASE FIDIA-GEORGETOWN INSTITUTE FOR THE NEUROSCIENCES (US) 1990-08-07 US disclosed
EP-0299513-A1 Azetidine derivatives, compositions and their use FIDIA-GEORGETOWN INSTITUTE FOR THE NEUROSCIENCES (US) 1989-01-18 EP disclosed