SCHEMBL17345293

SCHEMBL17345293

C[C@@H](NC(=O)c1ccncc1)C(=O)N1CCC[C@H]1C(N)=O

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PREP P48147 10/20 0.69
▸ FAP Q12884 7/20 0.69
▸ DPP8 Q6V1X1 1/20 0.69
▸ DPP9 Q86TI2 1/20 0.69
▸ ACE P12821 3/20 0.47
▸ MBOAT4 Q96T53 1/20 0.47
▸ DPP4 P27487 1/20 0.44

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
SCHEMBL17345171 0.89 PREP (0.70) PREPFAPDPP8DPP9ACE
SCHEMBL26616429 0.88 PREP (0.67) PREPFAPDPP8DPP9ACE
SCHEMBL26616424 0.88 PREP (0.67) PREPFAPDPP8DPP9ACE
SCHEMBL24067537 0.82 PREP (0.70) PREPFAPDPP8DPP9ACE
SCHEMBL29359250 0.81 PREP (1.00) PREPFAPDPP8DPP9DPP4
SCHEMBL17345172 0.80 PREP (0.58) PREPFAPDPP8DPP9ACE
SCHEMBL18806486 0.80 ACE (0.57) PREPFAPDPP8DPP9ACE
SCHEMBL13950866 0.80 PREP (0.47) PREPFAPDPP8DPP9ACE
SCHEMBL25822722 0.79 PREP (0.54) PREPFAPDPP8DPP9ACE
SCHEMBL11435575 0.78 ACE (0.71) PREPFAPACE

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
WO-2015192123-A1 FAP-ACTIVATED THERAPEUTIC AGENTS, AND USES RELATED THERETO TRUSTEES OF TUFTS COLLEGE (US) 2015-12-17 — — WO disclosed
WO-2015192124-A1 FAP-ACTIVATED THERAPEUTIC AGENTS, AND USES RELATED THERETO TRUSTEES OF TUFTS COLLEGE (US) 2015-12-17 — — WO disclosed
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