SCHEMBL2472353

SCHEMBL2472353

COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN(CC(=O)O)Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.63
▸ MEN1 O00255 3/20 0.63
▸ HCRTR1 O43613 1/20 0.63
▸ MAPT P10636 2/20 0.57
▸ NPBWR1 P48145 1/20 0.57
▸ MCHR1 Q99705 1/20 0.57
▸ TACR1 P25103 6/20 0.56
▸ TP53 P04637 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL2472360 1.00 KMT2A (0.63) KMT2AMEN1HCRTR1MAPTNPBWR1
SCHEMBL9705521 0.92 KMT2A (0.65) KMT2AMEN1HCRTR1MAPTNPBWR1
SCHEMBL9510921 0.91 KMT2A (0.64) KMT2AMEN1HCRTR1MAPTNPBWR1
SCHEMBL2474935 0.90 LTA4H (0.58) TACR1TP53
SCHEMBL2474927 0.90 LTA4H (0.58) TACR1TP53
SCHEMBL2473910 0.83 ATM (0.55) KMT2AMEN1
SCHEMBL2473913 0.83 ATM (0.55) KMT2AMEN1
SCHEMBL5381876 0.83 KMT2A (0.61) KMT2AMEN1HCRTR1MAPTNPBWR1
SCHEMBL27763768 0.83 KMT2A (0.78) KMT2AMEN1HCRTR1MAPTNPBWR1
SCHEMBL19051485 0.82 KMT2A (0.78) KMT2AMEN1HCRTR1MAPTNPBWR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2371421-A1 Ligands of insulin degrading enzyme and their uses Université de Lille 2 Droit et Santé (FR) 2011-10-05 — — EP disclosed
WO-2011107948-A2 LIGANDS OF INSULIN DEGRADING ENZYME AND THEIR USES UNIVERSITE LILLE 2 DROIT ET SANTE (FR) 2011-09-09 — — WO disclosed
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