SCHEMBL19937334

SCHEMBL19937334

CC(c1ccc(N2CCC(F)C2)cc1)C(N)CF

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 20/20 0.44
▸ DPP7 Q9UHL4 17/20 0.44
▸ DPP8 Q6V1X1 8/20 0.40
▸ DPP9 Q86TI2 4/20 0.40
▸ KCNH2 Q12809 2/20 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
SCHEMBL14023963 0.83 DPP4 (0.37) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL15628606 0.83 DPP4 (0.35) DPP4DPP7
SCHEMBL15628549 0.83 DPP4 (0.35) DPP4DPP7
SCHEMBL25016625 0.79 HRH3 (0.45) DPP4DPP7
SCHEMBL25017269 0.79 HRH3 (0.45) DPP4DPP7
SCHEMBL14023952 0.74 DPP4 (0.36) DPP4DPP7DPP8DPP9
SCHEMBL14023957 0.74 DPP4 (0.36) DPP4DPP7DPP8DPP9
SCHEMBL19937529 0.72 USP2 (0.37) DPP4
SCHEMBL20026251 0.71 ACACB (0.35) —
SCHEMBL19937463 0.70 DPP4 (0.38) DPP4DPP7

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
EP-3290427-A1 TRIAZOLE COMPOUNDS AND METHODS OF MAKING AND USING THE SAME Melinta Therapeutics, Inc. (US) 2018-03-07 — — EP disclosed
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