SCHEMBL9684341

SCHEMBL9684341

CCCCNC(=O)C(C)C[C@H](O)[C@@H](N)CC1CCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 18/20 1.00
METAP2 P50579 1/20 0.65
BCHE P06276 1/20 0.48

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
SCHEMBL14420370 1.00 REN (1.00) RENMETAP2BCHE
SCHEMBL14415351 1.00 REN (1.00) RENMETAP2BCHE
SCHEMBL14415355 0.88 REN (0.79) RENMETAP2BCHE
SCHEMBL7323798 0.88 REN (0.79) RENMETAP2BCHE
SCHEMBL9858453 0.88 REN (0.79) RENMETAP2BCHE
SCHEMBL7296545 0.88 REN (0.79) RENMETAP2BCHE
SCHEMBL7284318 0.88 REN (0.79) RENMETAP2BCHE
SCHEMBL9575598 0.88 REN (0.79) RENMETAP2BCHE
SCHEMBL14415375 0.87 REN (0.77) RENMETAP2BCHE
SCHEMBL14420373 0.87 REN (0.77) RENMETAP2BCHE

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-5091425-A Inhibitors of the catalytic action of renin IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-25 US disclosed