SCHEMBL2474935

SCHEMBL2474935

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

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.58
▸ ALOX15 P16050 1/20 0.58
▸ ACE P12821 4/20 0.58
▸ TACR1 P25103 1/20 0.58
▸ ITGB2 P05107 3/20 0.57
▸ ICAM1 P05362 3/20 0.57
▸ ITGAL P20701 3/20 0.57
▸ ERAP2 Q6P179 1/20 0.56
▸ P2RY14 Q15391 1/20 0.56
▸ TP53 P04637 1/20 0.56
▸ POLB P06746 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
SCHEMBL2474927 1.00 LTA4H (0.58) LTA4HALOX15ACETACR1ITGB2
SCHEMBL2472360 0.90 KMT2A (0.63) TACR1TP53
SCHEMBL2472353 0.90 KMT2A (0.63) TACR1TP53
SCHEMBL3388808 0.85 ALOX15 (0.60) ALOX15ACEITGB2ICAM1ITGAL
SCHEMBL30919264 0.83 ALOX15 (0.67) ALOX15ACEITGB2ICAM1ITGAL
SCHEMBL28046779 0.83 ECE1 (0.71) LTA4HALOX15ACEITGB2ICAM1
SCHEMBL11591677 0.83 ECE1 (0.71) LTA4HALOX15ACEITGB2ICAM1
SCHEMBL30936746 0.83 ALOX15 (0.70) ALOX15ACEITGB2ICAM1ITGAL
SCHEMBL6426552 0.82 ALOX15 (0.68) ALOX15ACEITGB2ICAM1ITGAL
SCHEMBL11369495 0.82 ALOX15 (0.68) ALOX15ACEITGB2ICAM1ITGAL

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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