SCHEMBL17089980

SCHEMBL17089980

CC(C)S(=O)(=O)NCCCCCNc1cccnc1Oc1ccc(F)cc1F

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.49
CARM1 Q86X55 2/20 0.46
PRMT6 Q96LA8 1/20 0.46
P2RY1 P47900 5/20 0.44
NPY5R Q15761 3/20 0.43
MAPK8 P45983 2/20 0.42
HTR1A P08908 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
TRPA1 O75762 1/20 0.39
MAPK14 Q16539 5/20 0.39
MAPK11 Q15759 2/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 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
SCHEMBL13565656 0.86 MAPT (0.49) MAPTCARM1PRMT6P2RY1MAPK8
SCHEMBL10113797 0.86 MAPT (0.55) MAPTCARM1PRMT6P2RY1
SCHEMBL11934973 0.83 MAPT (0.54) MAPTCARM1PRMT6P2RY1HTR1A
SCHEMBL13565433 0.80 NPY5R (0.43) P2RY1NPY5R
SCHEMBL13565169 0.78 GRIA1 (0.51) NPY5R
SCHEMBL13565874 0.77 MAPT (0.46) MAPTCARM1PRMT6P2RY1HTR1A
SCHEMBL11935733 0.73 GRIA1 (0.54) NPY5R
SCHEMBL10113525 0.73 MAPT (0.55) MAPTCARM1PRMT6P2RY1
SCHEMBL13113420 0.72 MAPT (0.64) MAPTCARM1PRMT6P2RY1HTR1A
SCHEMBL13565855 0.71 HTR1A (0.56) NPY5RHTR1A

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-9139518-B2 Amine derivative having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2015-09-22 US disclosed