SCHEMBL30874837

SCHEMBL30874837

NC(=O)C1CCCN1C(=O)CN1CCNCC1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 8/20 0.39
▸ OPRM1 P35372 1/20 0.39
▸ OPRL1 P41146 1/20 0.39
▸ HTR1A P08908 6/20 0.36
▸ HTR7 P34969 6/20 0.36
▸ ACE P12821 1/20 0.35
▸ PARG Q86W56 1/20 0.35
▸ TSHR P16473 1/20 0.34

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
SCHEMBL30874814 0.74 OPRM1 (0.41) DPP4OPRM1OPRL1HTR1AHTR7
SCHEMBL1483515 0.74 TSHR (0.55) OPRM1OPRL1TSHR
SCHEMBL13812370 0.73 GAA (0.43) —
SCHEMBL28466485 0.72 GAA (0.45) TSHR
SCHEMBL30455271 0.71 DDB1 (0.40) —
SCHEMBL15856041 0.71 DPP4 (0.44) DPP4HTR1AHTR7ACE
SCHEMBL8772871 0.69 DPP4 (0.56) DPP4HTR1AHTR7ACE
SCHEMBL1493753 0.69 DPP4 (0.47) DPP4HTR1AHTR7ACE
SCHEMBL8772866 0.69 DPP4 (0.56) DPP4HTR1AHTR7ACE
SCHEMBL3833137 0.69 TSHR (0.44) ACETSHR

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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