SCHEMBL27958463

SCHEMBL27958463

NC(=O)c1ccnn1CCC=O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.36
▸ FLT1 P17948 9/20 0.35
▸ KDR P35968 9/20 0.35
▸ GPR52 Q9Y2T5 1/20 0.34
▸ CCNC P24863 1/20 0.33
▸ CDK8 P49336 1/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ NR3C2 P08235 1/20 0.32
▸ RAB9A P51151 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ HTT P42858 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
SCHEMBL30230974 0.84 MAPK1 (0.35) MAPK1FLT1KDRGPR52CCNC
SCHEMBL22125797 0.81 MAPK1 (0.39) MAPK1FLT1KDRCCNCCDK8
SCHEMBL28539426 0.80 FLT1 (0.36) MAPK1FLT1KDRCCNCCDK8
SCHEMBL5496670 0.79 HASPIN (0.38) MAPK1FLT1KDRCCNCCDK8
SCHEMBL4327167 0.79 NR3C2 (0.47) MAPK1FLT1KDRCCNCCDK8
SCHEMBL22125615 0.78 MAPK1 (0.37) MAPK1FLT1KDRCCNCCDK8
SCHEMBL22125767 0.77 ALDH1A1 (0.41) MAPK1FLT1KDRALDH1A1SMN1; SMN2
SCHEMBL22125846 0.77 FLT1 (0.40) MAPK1FLT1KDRCCNCCDK8
SCHEMBL30282550 0.76 ALDH1A1 (0.40) MAPK1FLT1KDRALDH1A1SMN1; SMN2
SCHEMBL22125776 0.75 MAPK1 (0.38) MAPK1FLT1KDRCCNCCDK8

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
CN-103819405-A Method for preparing N-(1-(2-formyloxy ethyl)-1H-pyrazole-5-base) formamide WANG XIANGSHAN 2014-05-28 — — CN claimed
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