SCHEMBL7344352

SCHEMBL7344352

O=C(OCc1ccccc1)c1ncoc1CCNC(=O)[C@H](Cc1ccccc1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NMBR P28336 8/20 0.57
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CA2 P00918 1/20 0.49
BMP1 P13497 1/20 0.49
BRS3 P32247 3/20 0.49
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL7354156 0.86 KMT2A (0.55) NMBRMEN1KMT2ABRS3MAPT
SCHEMBL7341910 0.84 MEN1 (0.42) NMBRMEN1KMT2AMAPT
SCHEMBL7433554 0.84 CTSL (0.40) MAPT
SCHEMBL7384083 0.82 NMBR (0.43) NMBRMEN1KMT2ACA2BMP1
SCHEMBL7434571 0.79 ADAM17 (0.37) MAPT
SCHEMBL7433267 0.79 CTSL (0.54) NMBR
SCHEMBL10420266 0.78 TACR1 (0.67) NMBRMEN1KMT2AGAAMAPT
SCHEMBL7348054 0.77 LNPEP (0.63) NMBR
SCHEMBL7351604 0.76 MMP8 (0.39) KMT2AHTT
SCHEMBL7434646 0.76 CTSC (0.37) MEN1KMT2AGAAMAPT

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
US-5523313-A HYPOTENSIVE AGENTS; CARDIOTONIC AGENTS; INHIBITORS OF NEUTRAL METALLOENDOPEPTIDASES; VASODILATION; HEART FAILURE AND RENAL INSUFFICIENCY TANABE SEIYAKU CO., LTD. (JP) 1996-06-04 US disclosed
EP-0690070-A1 Indole-containing peptide and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1996-01-03 EP disclosed