SCHEMBL7368940

SCHEMBL7368940

NC(=O)C1CC(CCF)CCN1C(=O)[CH]Cc1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 3/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
MAOB P27338 3/20 0.37
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35
DPP4 P27487 3/20 0.34
FAP Q12884 2/20 0.34
DPP8 Q6V1X1 2/20 0.34
DPP9 Q86TI2 2/20 0.34
DPP7 Q9UHL4 2/20 0.34
AGTR2 P50052 1/20 0.34
CHRM4 P08173 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL7360568 0.91 DPP4 (0.36) CCR3SLC6A2SLC6A4SLC6A3MAOB
SCHEMBL7367539 0.91 DPP4 (0.33) CCR3SLC6A2SLC6A4SLC6A3MAOB
SCHEMBL7361665 0.90 GAA (0.36) DPP4CHRM4SMN1; SMN2
SCHEMBL3258336 0.85 MAOB (0.39) CCR3SLC6A2SLC6A4SLC6A3MAOB
SCHEMBL3140691 0.85 MAOB (0.39) CCR3SLC6A2SLC6A4SLC6A3MAOB
SCHEMBL3145715 0.82 MAOB (0.37) CCR3SLC6A2SLC6A4SLC6A3MAOB
SCHEMBL7366933 0.81 SIGMAR1 (0.33) CCR3SLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL3136103 0.81 HTR1A (0.50) MAOBHTR1AHTR7DPP4FAP
SCHEMBL7364616 0.80 GAA (0.39) DPP4
SCHEMBL3129734 0.78 GBA1 (0.37) CCR3SLC6A2SLC6A4SLC6A3MAOB

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-1997046553-A1 THROMBIN INHIBITORS NOVARTIS AG (CH) 1997-12-11 WO disclosed