SCHEMBL12807246

SCHEMBL12807246

Cc1nc(C(=O)N2CCCC2)cc(-c2ccc(Cl)cc2Cl)c1CN

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 17/20 1.00
▸ DPP8 Q6V1X1 13/20 1.00
▸ DPP9 Q86TI2 8/20 0.68
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ CASP3 P42574 1/20 0.52
▸ SENP8 Q96LD8 1/20 0.52
▸ SENP7 Q9BQF6 1/20 0.52
▸ SENP6 Q9GZR1 1/20 0.52
▸ CNR1 P21554 1/20 0.52

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
SCHEMBL12807243 0.83 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL8254459 0.81 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL8252761 0.80 DPP4 (0.98) DPP4DPP8DPP9
SCHEMBL12807245 0.80 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL8259030 0.79 DPP4 (0.96) DPP4DPP8DPP9
SCHEMBL12807262 0.78 DPP4 (1.00) DPP4DPP8DPP9NPC1RAB9A
SCHEMBL12807244 0.75 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL8252584 0.74 DPP4 (0.86) DPP4DPP8DPP9
SCHEMBL8257315 0.74 DPP4 (0.86) DPP4DPP8DPP9
SCHEMBL8259034 0.73 DPP4 (0.85) DPP4DPP8DPP9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2308847-B1 Substituted pyridines as inhibitors of dipeptidyl peptidase IV and their application for the treatment of diabetes and related diseases EMC MICROCOLLECTIONS GMBH (DE) 2014-04-02 — — EP disclosed
EP-2308847-A1 Substituted pyridines as inhibitors of dipeptidyl peptidase IV and their application for the treatment of diabetes and related diseases EMC microcollections GmbH (DE) 2011-04-13 — — EP disclosed
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