SCHEMBL10609342

SCHEMBL10609342

CCCSCC(=O)NCC[C@H](O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 17/20 0.46
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43
CTSD P07339 1/20 0.40
CTSE P14091 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL7447491 0.83 REN (0.51) RENCTSSCTSK
SCHEMBL10606451 0.82 REN (0.59) RENCTSSCTSKCTSDCTSE
SCHEMBL10608789 0.82 REN (0.46) RENCTSSCTSKCTSDCTSE
SCHEMBL10444182 0.79 REN (0.53) RENCTSSCTSK
SCHEMBL10444184 0.79 REN (0.53) RENCTSSCTSK
SCHEMBL12991841 0.79 REN (0.49) RENCTSSCTSK
SCHEMBL7430523 0.79 CTSS (0.52) RENCTSSCTSKCTSDCTSE
SCHEMBL10608861 0.78 REN (0.50) REN
SCHEMBL9833907 0.78 CTSS (0.51) RENCTSSCTSKCTSDCTSE
SCHEMBL3606572 0.78 CTSS (0.53) RENCTSSCTSKCTSDCTSE

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-4857507-A HYPOTENSIVE AGENT ABBOTT LABORATORIES (US) 1989-08-15 US disclosed