SCHEMBL1653870

SCHEMBL1653870

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

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 4/20 0.36
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 1/20 0.34
▸ MEP1B Q16820 1/20 0.34
▸ ALPL P05186 1/20 0.34
▸ KDM4E B2RXH2 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RHEB Q15382 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ RCE1 Q9Y256 1/20 0.33
▸ KIT P10721 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL11913421 0.92 HSD17B10 (0.36) ACLYMEP1BKDM4EALDH1A1HSD17B10
SCHEMBL1655510 0.87 ALPL (0.32) ALPLKDM4EALDH1A1HSD17B10HPGD
SCHEMBL11913441 0.84 SGK1 (0.34) MEP1BKIT
SCHEMBL11903159 0.82 ALPL (0.35) ACLYMEP1BALPLKDM4EALDH1A1
SCHEMBL11918060 0.82 MEP1B (0.33) MEP1BKIT
SCHEMBL11902816 0.81 TAS1R3 (0.37) ACLYTAS1R3TAS1R1MEP1BALPL
SCHEMBL11902934 0.81 TRPV1 (0.39) ACLYKDM4EALDH1A1HSD17B10RHEB
SCHEMBL117789 0.79 TAS1R3 (0.40) ACLYTAS1R3TAS1R1MEP1BALPL
SCHEMBL1654718 0.79 TAS1R3 (0.34) ACLYTAS1R3TAS1R1MEP1BALPL
SCHEMBL1115268 0.78 TAS1R3 (0.39) ACLYTAS1R3TAS1R1MEP1BALPL

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
WO-2011045561-A2 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2011-04-21 — — WO 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 ACLY 537/4885TAS1R3 4361/4885TAS1R1 4355/4885

“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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