SCHEMBL26424124

SCHEMBL26424124

NC(=O)CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 3/20 0.61
HPGDS O60760 2/20 0.60
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
HCRTR1 O43613 1/20 0.59
NPBWR1 P48145 1/20 0.56
MCHR1 Q99705 1/20 0.56
ERAP2 Q6P179 1/20 0.54
ALOX15 P16050 1/20 0.53
MC5R P33032 2/20 0.53
MC1R Q01726 2/20 0.53
ACE P12821 1/20 0.53
F10 P00742 1/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA9 Q16790 1/20 0.52
KDM4E B2RXH2 2/20 0.52
LMNA P02545 1/20 0.52
MPO P05164 1/20 0.52
MAPT P10636 1/20 0.52

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
SCHEMBL26424521 0.94 MEN1 (0.64) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL26428314 0.92 ECE1 (0.61) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL26412803 0.92 ECE1 (0.61) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL22851067 0.90 ECE1 (0.61) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL26416479 0.90 ECE1 (0.61) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL26336788 0.89 ECE1 (0.57) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL26414216 0.88 MEN1 (0.63) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL26418688 0.88 ECE1 (0.59) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL31238592 0.88 ECE1 (0.64) ECE1HPGDSMEN1KMT2AHCRTR1
SCHEMBL24024006 0.87 MEN1 (0.62) ECE1HPGDSMEN1KMT2AHCRTR1

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-4170347-A1 GASTRIC INHIBITORY PEPTIDE RECEPTOR LIGANDS 3B Pharmaceuticals GmbH (DE) 2023-04-26 EP disclosed