SCHEMBL8194337

SCHEMBL8194337

C[C@@H](O)[C@H]1C(=O)N2C(C(=O)OCOC(=O)C(C)(C)C)=C(c3cn4c(CO)ncc4s3)[C@H](C)[C@H]12

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FAP Q12884 1/20 0.47

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
SCHEMBL8194895 0.91 FAP (0.47) FAP
SCHEMBL8187676 0.89 FAP (0.46) FAP
SCHEMBL7631792 0.85 CACNA1C (0.35) FAP
SCHEMBL7722353 0.81 FAP (0.46) FAP
SCHEMBL8194666 0.81 FAP (0.48) FAP
SCHEMBL7636725 0.81 PLCG1 (0.36) FAP
SCHEMBL7729776 0.81 FAP (0.46) FAP
SCHEMBL7722325 0.81 FAP (0.46) FAP
SCHEMBL7730646 0.81 FAP (0.46) FAP
SCHEMBL7722410 0.80 FAP (0.46) FAP

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-1000064-A1 COMPOUNDS AstraZeneca UK Limited (GB) 2000-05-17 EP disclosed
WO-1999001455-A1 COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1999-01-14 WO disclosed