SCHEMBL30626331

SCHEMBL30626331

N#Cc1ccc(-n2nc(C(=O)O)c(=O)c3c(C#N)cccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
ABCB1 P08183 1/20 0.40
RARG P13631 1/20 0.39
SCN9A Q15858 2/20 0.39
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CCNA1 P78396 1/20 0.37
RORC P51449 1/20 0.36
XDH P47989 1/20 0.36
RPA1 P27694 1/20 0.35
HSD11B1 P28845 1/20 0.35

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
SCHEMBL26074934 1.00 KDM4E (0.42) KDM4EABCB1RARGSCN9AALOX15
SCHEMBL30626334 0.89 CYP1A2 (0.45) KDM4EABCB1RARGALOX15HSD17B10
SCHEMBL26074925 0.89 CYP1A2 (0.45) KDM4EABCB1RARGALOX15HSD17B10
SCHEMBL26075498 0.89 KDM4E (0.46) KDM4ERARGALOX15HSD17B10ALDH1A1
SCHEMBL26074959 0.88 KDM4E (0.40) KDM4EHSD17B10ALDH1A1NPSR1TP53
SCHEMBL30626340 0.88 KDM4E (0.40) KDM4EHSD17B10ALDH1A1NPSR1TP53
SCHEMBL30626339 0.86 KDM4E (0.41) KDM4ERARGSCN9AALOX15HSD17B10
SCHEMBL30626350 0.86 SCN9A (0.41) KDM4ESCN9AALDH1A1HPGDNPSR1
SCHEMBL26075507 0.86 KDM4E (0.39) KDM4ERARGSCN9AALOX15HSD17B10
SCHEMBL26074932 0.86 SCN9A (0.41) KDM4ESCN9AALDH1A1HPGDNPSR1

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
US-20230303498-A1 HERBICIDAL CINNOLINE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2023-09-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230303498-A1 HERBICIDAL CINNOLINE DERIVATIVES DDT, DERL1, MTX1 KDM4E 2666/4885ABCB1 501/4885RARG 4208/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.