SCHEMBL24447774

SCHEMBL24447774

N#CC1CC(C(=O)Nc2ccccc2)CN1C(=O)CNC(=O)Nc1ccc2ccccc2c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ PREP P48147 3/20 0.45
▸ EPHX1 P07099 3/20 0.42
▸ PRMT3 O60678 5/20 0.40
▸ DPP4 P27487 4/20 0.39
▸ DPP8 Q6V1X1 2/20 0.39
▸ DPP7 Q9UHL4 2/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ DPP9 Q86TI2 1/20 0.39

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
SCHEMBL24448520 0.91 PREP (0.45) PREPDPP4DPP8DPP7
SCHEMBL24448169 0.88 PREP (0.43) NPC1RAB9APREPDPP4DPP8
SCHEMBL24447985 0.83 DPP4 (0.45) PREPDPP4DPP8DPP7
SCHEMBL24932678 0.82 PREP (0.45) PREPDPP4DPP8DPP7
SCHEMBL24447487 0.82 PREP (0.44) PREPDPP4DPP8DPP7DPP9
SCHEMBL24447121 0.80 EPHX1 (0.47) NPC1RAB9APREPEPHX1DPP4
SCHEMBL24932568 0.80 DPP4 (0.44) MAPTPREPDPP4DPP8DPP7
SCHEMBL11377789 0.80 DPP4 (0.50) PREPEPHX1DPP4DPP8DPP7
SCHEMBL24447064 0.78 DPP4 (0.46) PREPDPP4DPP8DPP7DPP9
SCHEMBL24447476 0.78 MEN1 (0.44) NPC1MAPTRAB9ADPP4DPP8

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-4001279-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS Enanta Pharmaceuticals, Inc. (US) 2022-05-25 — — EP disclosed
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