SCHEMBL23876261

SCHEMBL23876261

C[C@@H](NC(=O)c1ccc(NCC(=O)CN(CCN)CCN)cc1)C(=O)N1CCC[C@H]1B(O)O

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 15/20 0.59
▸ FAP Q12884 14/20 0.59
▸ DPP8 Q6V1X1 7/20 0.57
▸ DPP9 Q86TI2 7/20 0.57
▸ DPP4 P27487 8/20 0.40
▸ DPP7 Q9UHL4 5/20 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
SCHEMBL25890443 0.81 PREP (0.63) PREPFAPDPP8DPP9DPP4
SCHEMBL25890297 0.81 PREP (0.77) PREPFAPDPP8DPP9DPP4
SCHEMBL25890370 0.79 FAP (0.74) PREPFAPDPP8DPP9DPP4
SCHEMBL25890341 0.77 PREP (0.79) PREPFAPDPP8DPP9DPP4
SCHEMBL25896282 0.76 PREP (0.60) PREPFAPDPP8DPP9DPP4
SCHEMBL27262345 0.75 PREP (0.50) PREPFAPDPP8DPP9DPP4
SCHEMBL29359250 0.73 PREP (1.00) PREPFAPDPP8DPP9DPP4
SCHEMBL25892185 0.73 PREP (0.52) PREPFAPDPP8DPP9DPP4
SCHEMBL31758426 0.72 FAP (0.61) PREPFAPDPP8DPP9DPP4
SCHEMBL25896160 0.72 PREP (0.55) PREPFAPDPP8DPP9DPP4

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
WO-2021195198-A1 FAP-TARGETED RADIOPHARMACEUTICALS AND IMAGING AGENTS, AND USES RELATED THERETO TRUSTEES OF TUFTS COLLEGE (US) 2021-09-30 — — WO disclosed
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