SCHEMBL1655510

SCHEMBL1655510

COC(=O)c1nc(-c2ccc(Cl)c(N(C)C)c2F)nc2[nH]c(C)cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALPL P05186 2/20 0.32
▸ KDM4E B2RXH2 4/20 0.32
▸ ALDH1A1 P00352 4/20 0.32
▸ HSD17B10 Q99714 3/20 0.32
▸ HPGD P15428 2/20 0.32
▸ PKM P14618 2/20 0.31
▸ RHEB Q15382 1/20 0.31
▸ RCE1 Q9Y256 1/20 0.31
▸ MAP4K1 Q92918 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ S1PR4 O95977 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ KIT P10721 1/20 0.30
▸ ROCK2 O75116 1/20 0.30
▸ PRKACA P17612 1/20 0.30
▸ PRKACG P22612 1/20 0.30
▸ PRKACB P22694 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
SCHEMBL1653870 0.87 ACLY (0.36) ALPLKDM4EALDH1A1HSD17B10HPGD
SCHEMBL11913446 0.83 SGK1 (0.30) KIT
SCHEMBL11903262 0.82 LIMK1 (0.31) ALPLKDM4EALDH1A1HSD17B10HPGD
SCHEMBL11903110 0.80 ROCK2 (0.31) ALPLKDM4EALDH1A1HSD17B10HPGD
SCHEMBL10252352 0.79 KDM4E (0.35) ALPLKDM4EALDH1A1HSD17B10HPGD
SCHEMBL11913421 0.78 HSD17B10 (0.36) KDM4EALDH1A1HSD17B10
SCHEMBL11902934 0.78 TRPV1 (0.39) KDM4EALDH1A1HSD17B10PKMRHEB
SCHEMBL116281 0.78 KDM4E (0.36) ALPLKDM4EALDH1A1HSD17B10HPGD
SCHEMBL721102 0.76 KDM4E (0.35) KDM4EALDH1A1PKMRCE1MAP4K1
SCHEMBL119041 0.74 KDM4E (0.33) KDM4EALDH1A1PKMRCE1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488518-A2 HERBICIDAL COMPOUNDS Syngenta Limited (GB) 2012-08-22 — — EP disclosed
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — US disclosed
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — US disclosed
CN-102574849-A Herbicidal compounds SYNGENTA LTD 2012-07-11 — — CN disclosed
WO-2011045561-A2 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2011-04-21 — — WO 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-20120202690-A1 HERBICIDAL COMPOUNDS DDT, HAO2, HAAO ALPL 1784/4885KDM4E 3599/4885ALDH1A1 718/4885

“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.

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