SCHEMBL7438336

SCHEMBL7438336

CC(C)(C)OC(=O)C(N)c1ccc2c(c1)[CH]CO2

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.39
APP P05067 1/20 0.32
ALOX5 P09917 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL7684870 0.80 EDNRA (0.57) EDNRAPTGS1PTGS2
SCHEMBL7436742 0.73 APP (0.31) APP
SCHEMBL7276282 0.73 MMP12 (0.48)
SCHEMBL11085866 0.72 APP (0.36) EDNRAAPP
SCHEMBL7428737 0.72 FFAR1 (0.44)
SCHEMBL27677819 0.71 PTGS1 (0.47) EDNRAPTGS1PTGS2
SCHEMBL27684645 0.71 PTGS1 (0.47) EDNRAPTGS1PTGS2
SCHEMBL1992570 0.70 EDNRA (0.34) EDNRA
SCHEMBL1205124 0.70 HSD17B10 (0.61) EDNRAAPP
SCHEMBL7448758 0.70 KMT2A (0.39) APP

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
EP-0375451-A2 Compounds having a renin-inhibiting activity BEECHAM GROUP PLC (GB) 1990-06-27 EP disclosed