SCHEMBL9725818

SCHEMBL9725818

CC(C)(C)OC(=O)NC(CC1CCCCC1)C(O)c1ccccn1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 18/20 0.53
CTSD P07339 1/20 0.53
CTSE P14091 1/20 0.53
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL9725825 1.00 REN (0.53) RENCTSDCTSECTSSCTSK
SCHEMBL9725812 1.00 REN (0.53) RENCTSDCTSECTSSCTSK
SCHEMBL9739264 1.00 REN (0.53) RENCTSDCTSECTSSCTSK
SCHEMBL9749328 0.89 REN (0.53) RENCTSDCTSE
SCHEMBL9741114 0.85 REN (0.49) RENCTSDCTSE
SCHEMBL9513094 0.84 REN (0.62) RENCTSDCTSE
SCHEMBL9512616 0.83 REN (0.61) RENCTSDCTSE
SCHEMBL7274657 0.81 REN (0.60) RENCTSDCTSE
SCHEMBL9725793 0.80 CA1 (0.44) RENCTSDCTSE
SCHEMBL7289460 0.80 CA1 (0.44) RENCTSDCTSE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5106835-A Hypotensive agents AMERICAN CYANAMID COMPANY (US) 1992-04-21 US disclosed
US-5104869-A Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1992-04-14 US disclosed
EP-0427939-A2 Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1991-05-22 EP disclosed