SCHEMBL12559277

SCHEMBL12559277

CCc1ccc2nc(-c3cc(C(F)(F)F)nn3-c3ncccc3Cl)oc(=O)c2c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HPN P05981 1/20 0.37
▸ HSD11B1 P28845 1/20 0.35
▸ KLK7 P49862 1/20 0.35
▸ KLK14 Q9P0G3 1/20 0.35
▸ KLK5 Q9Y337 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ CDK8 P49336 1/20 0.35
▸ ACVR1 Q04771 1/20 0.35
▸ CLK4 Q9HAZ1 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ CARM1 Q86X55 1/20 0.34
▸ ELANE P08246 9/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ C1R P00736 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
SCHEMBL13072420 0.93 ELANE (0.39) HSD11B1KLK7KLK14KLK5ACVR1
SCHEMBL950741 0.89 ELANE (0.45) HSD11B1ELANEKDM4EL3MBTL1C1R
SCHEMBL950869 0.88 C1R (0.43) HSD11B1PTGS1PTGS2KDM4EL3MBTL1
SCHEMBL12559403 0.87 KDM4E (0.39) KLK7KLK14KLK5PTGS1PTGS2
SCHEMBL13072499 0.86 CARM1 (0.34) HSD11B1PTGS1PTGS2CARM1ELANE
SCHEMBL12560144 0.86 PTGS2 (0.33) HSD11B1PTGS1PTGS2CARM1KDM4E
SCHEMBL950464 0.83 C1R (0.42) ELANEKDM4EL3MBTL1C1R
SCHEMBL949711 0.83 APEX1 (0.45) HSD11B1PTGS1PTGS2ELANEKDM4E
SCHEMBL4080657 0.82 ELANE (0.38) PTGS1PTGS2CARM1ELANEKDM4E
SCHEMBL14495253 0.82 KDM4E (0.33) PTGS1PTGS2CARM1ELANEKDM4E

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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