SCHEMBL1226463

SCHEMBL1226463

CCCCCNC(=O)N1C=CC=NC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.43
ASAH1 Q13510 6/20 0.40
EPHX1 P07099 5/20 0.40
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPK3 P27361 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SQOR Q9Y6N5 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
SCHEMBL10479267 0.99 NAMPT (0.45) NAMPTASAH1EPHX1LMNACYP3A4
SCHEMBL28061960 0.72
SCHEMBL28323379 0.71
SCHEMBL27860620 0.70 PKM (0.35) CYP3A4SMN1; SMN2
SCHEMBL27847236 0.70 KDM4E (0.45) ASAH1
SCHEMBL10377419 0.68 ALDH1A1 (0.38)
SCHEMBL27674320 0.67
SCHEMBL28312655 0.66
SCHEMBL24176160 0.65 TDP1 (0.65) NAMPTEPHX1
SCHEMBL10739485 0.65 TDP1 (0.65) NAMPTEPHX1

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-2011017545-A1 N1-SUBSTITUTED-5-FLUORO-2-OXOPYRIMIDINONE-1(2H)-CARBOXAMIDE DERIVATIVES DOW AGROSCIENCES LLC (US) 2011-02-10 WO disclosed