SCHEMBL9225842

SCHEMBL9225842

CC1(C)OCO[C@H]1C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@](N)(Cc1c[nH]cn1)C(=O)[C@H](Cc1ccccc1)OC(=O)N1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.42

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
SCHEMBL9229683 0.89 REN (0.42) REN
SCHEMBL9225837 0.86 REN (0.54) REN
SCHEMBL9231039 0.84 REN (0.36) REN
SCHEMBL9229678 0.79 REN (0.51) REN
SCHEMBL8684049 0.79 REN (0.32) REN
SCHEMBL9225840 0.77 REN (0.40) REN
SCHEMBL9231036 0.76 REN (0.46) REN
SCHEMBL9230025 0.76 REN (0.54) REN
SCHEMBL9222971 0.76 REN (0.54) REN
Hydrochloric Acid SCHEMBL9231934 0.75 REN (0.54) REN

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
EP-0656356-A1 DIOXACYCLOALKANE COMPOUND WITH RENIN-INHIBITING ACTIVITY JAPAN TOBACCO INC. (JP) 1995-06-07 EP claimed
EP-0656356-A1 DIOXACYCLOALKANE COMPOUND WITH RENIN-INHIBITING ACTIVITY JAPAN TOBACCO INC. (JP) 1995-06-07 EP disclosed