SCHEMBL4745990

SCHEMBL4745990

COC1CCCC(N2CCC(N)CC2)C1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31

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
SCHEMBL14041863 1.00 DPP4 (0.38) DPP4DPP7ALDH1A1TSHRHRH3
SCHEMBL26619643 0.85 DPP4 (0.38) DPP4DPP7ALDH1A1TSHRHRH3
SCHEMBL4745992 0.79 DPP4 (0.33) DPP4
SCHEMBL4745995 0.79 DPP4 (0.33) DPP4
SCHEMBL4745991 0.79 DPP4 (0.33) DPP4
SCHEMBL10190130 0.77 CHRM1 (0.33) HRH3
SCHEMBL26619663 0.77 DPP4 (0.35) DPP4DPP7HRH3
SCHEMBL24317423 0.76 DPP4 (0.33) DPP4DPP7
SCHEMBL4748656 0.76 DPP4 (0.36) DPP4DPP7ALDH1A1TSHRHRH3
SCHEMBL14042280 0.76 DPP4 (0.36) DPP4DPP7ALDH1A1TSHRHRH3

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
WO-2008119715-A1 1- (1-CYCLOHEXYL-4-PIPERIDINYL) -1, 3-DIHYDRO-2H-BENZIMIDAZOL-2-ONE DERIVATIVES WHICH HAVE ACTIVITY ON THE M1 RECEPTOR AND THEIR USE IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-10-09 WO disclosed