SCHEMBL27748965

SCHEMBL27748965

NCc1cc(Cl)cc(C(=O)NN)c1NC(=O)c1ccc(Br)n1-c1ncccn1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.34
ALDH1A1 P00352 1/20 0.33
PSD A5PKW4 1/20 0.32
P2RX7 Q99572 1/20 0.32
GRM5 P41594 5/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
F2 P00734 1/20 0.30
KCNMA1 Q12791 1/20 0.30

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
SCHEMBL27727873 0.89 PSD (0.34) F10ALDH1A1PSDP2RX7GRM5
SCHEMBL950777 0.87 P2RX7 (0.38) F10ALDH1A1P2RX7GRM5KDM4E
SCHEMBL27748962 0.82
SCHEMBL27749075 0.82 GRM5 (0.37) F10ALDH1A1P2RX7GRM5KCNMA1
SCHEMBL27727956 0.79 ALDH1A1 (0.33) F10ALDH1A1P2RX7GRM5IRAK4
SCHEMBL27728015 0.79 PSD (0.36) F10ALDH1A1PSDP2RX7GRM5
SCHEMBL12528663 0.78 F10 (0.37) F10PSD
SCHEMBL27896155 0.77 HSD17B10 (0.37) F10ALDH1A1GRM5KCNMA1
SCHEMBL27727960 0.77 DHODH (0.38) F10ALDH1A1PSDP2RX7GRM5
SCHEMBL27727947 0.77 PSD (0.34) F10ALDH1A1PSDP2RX7GRM5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101287721-B Hydrazide compound and pesticidal use of the same SUMITOMO CO LTD 2013-03-27 CN disclosed
CN-101287721-A Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL CO (JP) 2008-10-15 CN disclosed