SCHEMBL11032335

SCHEMBL11032335

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(=O)(CCCCc1ccccc1)OCc1ccccc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.50
ECE1 P42892 1/20 0.49
CAPN1 P07384 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
SCHEMBL11031852 0.93 MME (0.53) MMEECE1CAPN1
SCHEMBL11032734 0.92 MME (0.50) MMEECE1
SCHEMBL11032331 0.91 CETP (0.50) MMEECE1CAPN1
SCHEMBL11031918 0.91 CETP (0.50) MMEECE1CAPN1
SCHEMBL11030668 0.91 MME (0.49) MMEECE1CAPN1
SCHEMBL11031923 0.85 MMP3 (0.55) MMEECE1CAPN1
SCHEMBL11033973 0.85 MME (0.55) MMEECE1
SCHEMBL7275477 0.84 MME (0.58) MMEECE1CAPN1
SCHEMBL7275467 0.84 MME (0.58) MMEECE1CAPN1
SCHEMBL11031714 0.82 MME (0.56) MMEECE1

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
US-4432972-A HYPOTENSIVE AGENTS, KANALGESICS, AND ANGIOTENSIN AND ENKEPHALIN INHIBITION E. R. SQUIBB & SONS, INC. (US) 1984-02-21 US disclosed