SCHEMBL29181978

SCHEMBL29181978

O=C(NCC(=O)N1CCCC1C(=O)CO)c1ccnc2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FAP Q12884 18/20 0.73
PREP P48147 3/20 0.71
DPP7 Q9UHL4 2/20 0.69

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
SCHEMBL24927935 1.00 FAP (0.73) FAPPREPDPP7
SCHEMBL26876345 0.91 FAP (0.72) FAPPREPDPP7
SCHEMBL22811116 0.87 FAP (0.77) FAPPREP
SCHEMBL30169843 0.85 FAP (0.85) FAP
SCHEMBL25287846 0.85 FAP (1.00) FAP
SCHEMBL23896689 0.85 FAP (1.00) FAP
SCHEMBL30415865 0.85 FAP (1.00) FAP
SCHEMBL21101376 0.85 PREP (0.74) FAPPREPDPP7
SCHEMBL26223829 0.85 PREP (0.74) FAPPREPDPP7
SCHEMBL25239559 0.84 FAP (1.00) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117769443-A Fibroblast activation protein inhibitor and use thereof 3B制药有限公司 2024-03-26 CN disclosed