SCHEMBL10754306

SCHEMBL10754306

Cc1cc2c(c(Cl)c1N)CCCC2C#N

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.33
HRH3 Q9Y5N1 2/20 0.32
HRH2 P25021 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
UGT2B17 O75795 2/20 0.30

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
SCHEMBL10751500 0.87 NPSR1 (0.32) DPP4NPSR1
SCHEMBL10750795 0.76 NPSR1 (0.34) DPP4HRH3HRH2NPSR1
SCHEMBL10751966 0.75 DPP4 (0.33) DPP4
SCHEMBL10751216 0.74 DRD2 (0.35) NPSR1
SCHEMBL768366 0.73 UGT2B17 (0.57) DPP4NPSR1UGT2B17
SCHEMBL10749309 0.73 DPP4 (0.34) DPP4
SCHEMBL23813210 0.70 UGT2B17 (0.41) DPP4NPSR1UGT2B17
SCHEMBL769214 0.70 NOS3 (0.35) DPP4NPSR1
SCHEMBL10751929 0.70 ADRA1A (0.40)
SCHEMBL10752770 0.69 NPSR1 (0.36) DPP4NPSR1

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
US-4634705-A Adrenergic amidines ABBOTT LABORATORIES (US) 1987-01-06 US disclosed