SCHEMBL23458742

SCHEMBL23458742

NC(=O)c1ccnc(-c2cccnc2Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5C P41229 2/20 0.48
▸ KDM4B O94953 1/20 0.48
▸ KDM5B Q9UGL1 1/20 0.48
▸ PARP1 P09874 2/20 0.45
▸ MKNK1 Q9BUB5 2/20 0.44
▸ MKNK2 Q9HBH9 2/20 0.44
▸ KDM4C Q9H3R0 3/20 0.43
▸ MAP4K4 O95819 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ KDM6B O15054 1/20 0.43
▸ KDM4A O75164 1/20 0.43
▸ KDM2A Q9Y2K7 1/20 0.43
▸ KDM3A Q9Y4C1 1/20 0.43
▸ CHEK2 O96017 2/20 0.42
▸ PIM1 P11309 1/20 0.42
▸ F7 P08709 1/20 0.41
▸ F3 P13726 1/20 0.41
▸ SARM1 Q6SZW1 1/20 0.41
▸ SIRT2 Q8IXJ6 1/20 0.41
▸ SIRT6 Q8N6T7 1/20 0.41

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
SCHEMBL23458438 0.79 KDM4B (0.46) KDM5CKDM4BKDM5BPARP1MKNK1
SCHEMBL29933114 0.78 KDM1A (0.53) KDM5CKDM4BKDM5BPARP1KDM4C
SCHEMBL7038517 0.78 KDM5C (0.69) KDM5CKDM4BKDM5BPARP1MKNK1
SCHEMBL2335933 0.77 KDM4C (0.51) KDM5CKDM4BKDM5BPARP1MKNK1
SCHEMBL1758494 0.77 KDM4C (0.51) KDM5CKDM4BKDM5BPARP1MKNK1
SCHEMBL902063 0.76 KDM4E (0.72) KDM5CKDM4BKDM5BPARP1KDM4C
SCHEMBL23458760 0.75 KDM4B (0.47) KDM5CKDM4BKDM5BPARP1MKNK2
SCHEMBL39814 0.75 KDM4B (0.50) KDM5CKDM4BKDM5BPARP1KDM4C
SCHEMBL29933213 0.74 HDAC1 (0.58) KDM5CKDM4BKDM5BPARP1MKNK1
SCHEMBL26599271 0.74 KDM1A (0.57) KDM5CKDM4BKDM5BPARP1MKNK1

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-2021110890-A1 PYRIDINIUM DERIVATIVES AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2021-06-10 — — WO disclosed
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