SCHEMBL12630200

SCHEMBL12630200

CC(C)(NS(=O)(=O)c1cccc(OC2CCCC2)c1)c1ccc(CBr)nc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DUT P33316 11/20 0.56
▸ KAT6A Q92794 2/20 0.39
▸ GRM2 Q14416 2/20 0.34
▸ LNPEP Q9UIQ6 1/20 0.34
▸ EPHX2 P34913 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
SCHEMBL1409688 0.86 DUT (0.69) DUTKAT6A
SCHEMBL12629721 0.85 DUT (0.67) DUTKAT6AGRM2
SCHEMBL12630857 0.82 DUT (0.55) DUTKAT6A
SCHEMBL12629880 0.81 DUT (0.60) DUT
SCHEMBL27806918 0.79 DUT (0.67) DUTKAT6A
SCHEMBL12696987 0.76 DUT (0.69) DUTKAT6A
SCHEMBL20189654 0.72 DUT (0.70) DUTKAT6AGRM2
SCHEMBL1409352 0.71 DUT (0.67) DUTKAT6A
SCHEMBL18379994 0.71 DUT (0.68) DUTKAT6AGRM2
SCHEMBL20374165 0.70 DUT (0.67) DUTKAT6AEPHX2

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-2011065545-A1 5-FLUOROURACIL COMPOUND HAVING dUTPase-INHIBITING ACTIVITY OR SALT THEREOF 大鵬薬品工業株式会社 (JP) 2011-06-03 — — WO disclosed
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