SCHEMBL23138568

SCHEMBL23138568

CN1C[C@@H]2CN(I)CCN2C1=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.33

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
SCHEMBL23138574 1.00 DPP4 (0.33) DPP4
SCHEMBL18390617 0.80 HTR2A (0.42) DPP4
SCHEMBL24703359 0.78 DPP4 (0.32) DPP4
SCHEMBL24703358 0.74 DPP4 (0.34) DPP4
SCHEMBL21739492 0.74 DPP4 (0.32) DPP4
SCHEMBL26450622 0.74 DPP4 (0.34) DPP4
SCHEMBL24801729 0.74 DPP4 (0.37) DPP4
SCHEMBL21739320 0.74 DPP4 (0.34) DPP4
SCHEMBL24629551 0.74 HTR2A (0.37) DPP4
SCHEMBL761295 0.74 NOS1 (0.42) —

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-2021055744-A1 4-SUBSTITUTED INDOLE AND INDAZOLE SULFONAMIDO DERIVATIVES AS PARG INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2021-03-25 — — WO disclosed
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