SCHEMBL30874828

SCHEMBL30874828

NC(=O)C1CCCN1C(=O)Cc1nnn[nH]1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 10/20 0.40
▸ HTR1A P08908 10/20 0.39
▸ HTR7 P34969 10/20 0.39
▸ DPP9 Q86TI2 1/20 0.37

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
SCHEMBL30874950 0.77 DPP4 (0.42) DPP4HTR1AHTR7DPP9
SCHEMBL30341409 0.75 DPP4 (0.41) DPP4HTR1AHTR7DPP9
SCHEMBL30874947 0.74 DPP4 (0.39) DPP4HTR1AHTR7DPP9
SCHEMBL30874930 0.74 DPP4 (0.43) DPP4HTR1AHTR7DPP9
SCHEMBL8772871 0.73 DPP4 (0.56) DPP4HTR1AHTR7DPP9
SCHEMBL8772866 0.73 DPP4 (0.56) DPP4HTR1AHTR7DPP9
SCHEMBL30874924 0.72 HTR1A (0.39) DPP4HTR1AHTR7
Bromide SCHEMBL9464510 0.72 DPP4 (0.54) DPP4HTR1AHTR7DPP9
Bromide SCHEMBL9464396 0.72 DPP4 (0.54) DPP4HTR1AHTR7DPP9
Hydrochloric Acid SCHEMBL19692659 0.72 DPP4 (0.54) DPP4HTR1AHTR7DPP9

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-117956985-A Inhibitors of glycogen synthase 1 (GYS 1) and methods of use thereof 梅兹治疗公司 2024-04-30 — — CN disclosed
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