SCHEMBL12559403

SCHEMBL12559403

Nc1ccc2nc(-c3cc(C(F)(F)F)nn3-c3ncccc3Cl)oc(=O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PTGS2 P35354 4/20 0.35
▸ PTGS1 P23219 3/20 0.35
▸ C1R P00736 4/20 0.34
▸ ALDH1A1 P00352 4/20 0.33
▸ MAPT P10636 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ APEX1 P27695 1/20 0.33
▸ CARM1 Q86X55 1/20 0.33
▸ PRSS1 P07477 1/20 0.32
▸ CTSG P08311 1/20 0.32
▸ KLK7 P49862 1/20 0.32
▸ KLK14 Q9P0G3 1/20 0.32
▸ KLK5 Q9Y337 1/20 0.32
▸ NR3C2 P08235 1/20 0.32
▸ PDPK1 O15530 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ NPC1 O15118 1/20 0.32

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
SCHEMBL950869 0.91 C1R (0.43) KDM4EL3MBTL1PTGS2PTGS1C1R
SCHEMBL950741 0.89 ELANE (0.45) KDM4EL3MBTL1C1RALDH1A1MAPT
SCHEMBL12559277 0.87 HPN (0.37) KDM4EL3MBTL1PTGS2PTGS1C1R
SCHEMBL949711 0.85 APEX1 (0.45) KDM4EL3MBTL1PTGS2PTGS1C1R
SCHEMBL4080657 0.84 ELANE (0.38) KDM4EL3MBTL1PTGS2PTGS1C1R
SCHEMBL535653 0.84 F2 (0.44) KDM4EL3MBTL1PTGS2PTGS1C1R
SCHEMBL950464 0.84 C1R (0.42) KDM4EL3MBTL1C1RALDH1A1MAPT
SCHEMBL951585 0.83 ELANE (0.46) KDM4EL3MBTL1C1RALDH1A1MAPT
SCHEMBL950425 0.83 KDM4E (0.37) KDM4EL3MBTL1PTGS2PTGS1C1R
SCHEMBL4072275 0.82 KDM4E (0.37) KDM4EL3MBTL1PTGS2PTGS1C1R

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
EP-1937664-B1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2011-06-15 — — EP disclosed
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