SCHEMBL11030564

SCHEMBL11030564

C[C@H](NP(C)(=O)O)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 4/20 0.56
▸ ACE P12821 10/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ F2 P00734 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ LTA4H P09960 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ PEPD P12955 1/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ PTGS1 P23219 1/20 0.54
▸ HTR2A P28223 1/20 0.54
▸ PTGS2 P35354 1/20 0.54
▸ HRH1 P35367 1/20 0.54
▸ THPO P40225 1/20 0.54
▸ PMP22 Q01453 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ ACE2 Q9BYF1 1/20 0.54
▸ RAB9A P51151 1/20 0.46

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
SCHEMBL29696439 0.90 ACE (0.55) RENACEKDM4EF2LMNA
SCHEMBL7272881 0.83 ACE (0.55) RENACEKDM4EF2LMNA
SCHEMBL11031456 0.81 ACE (0.54) ACELMNALTA4HACE2
Hydrochloric Acid SCHEMBL7326358 0.81 ACE (0.57) RENACEKDM4EF2LMNA
SCHEMBL10658196 0.80 ACE (0.60) RENACEKDM4EF2LMNA
SCHEMBL19817050 0.80 ACE (0.60) RENACEKDM4EF2LMNA
SCHEMBL13019815 0.80 ACE (0.60) RENACEKDM4EF2LMNA
SCHEMBL11221776 0.79 ACE (0.55) ACELMNAACE2
SCHEMBL7271630 0.79 ACE (0.50) RENACEKDM4EF2LMNA
SCHEMBL11031153 0.79 ACE (0.47) RENACEKDM4EF2LMNA

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-4432971-A HYPOTENSIVE AGENTS AND ANGIOTENSIN INHIBITION E. R. SQUIBB & SONS, INC. (US) 1984-02-21 — — US disclosed
EP-0071544-A1 Phosphonamidate compounds E.R. Squibb & Sons, Inc. (US) 1983-02-09 — — EP disclosed
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