SCHEMBL1654718

SCHEMBL1654718

COC(=O)c1nc(-c2ccc(Cl)c(OC)c2F)nc2[nH]cc(C)c12

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 3/20 0.34
▸ TAS1R1 Q7RTX1 3/20 0.34
▸ MEP1B Q16820 1/20 0.34
▸ ACLY P53396 2/20 0.33
▸ KMO O15229 1/20 0.32
▸ DYRK1A Q13627 2/20 0.32
▸ TAS1R2 Q8TE23 2/20 0.32
▸ ALPL P05186 1/20 0.32
▸ NR4A2 P43354 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ HSP90AB1 P08238 1/20 0.31
▸ AXL P30530 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ RHEB Q15382 1/20 0.31
▸ MAPK14 Q16539 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ RCE1 Q9Y256 1/20 0.31

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
SCHEMBL11903334 0.92 JAK3 (0.38) MEP1BALDH1A1HSD17B10KMT2A
SCHEMBL1654720 0.92 KMO (0.41) TAS1R3TAS1R1MEP1BACLYKMO
SCHEMBL11902200 0.91 MEP1B (0.34) TAS1R3TAS1R1MEP1BKMO
SCHEMBL11903222 0.88 SMN1; SMN2 (0.34) TAS1R3TAS1R1MEP1BKDM4EALDH1A1
SCHEMBL12786369 0.87 DYRK1A (0.34) DYRK1AKDM4EALDH1A1HSD17B10HSP90AB1
SCHEMBL11903387 0.87 DHODH (0.36) HSD17B10KMT2A
SCHEMBL11902410 0.87 SMN1; SMN2 (0.34) MEP1BALDH1A1
SCHEMBL11902933 0.87 SMN1; SMN2 (0.34) MEP1BKDM4EALDH1A1KMT2A
SCHEMBL11903110 0.87 ROCK2 (0.31) KMOALPLNR4A2KDM4EALDH1A1
SCHEMBL11902404 0.86 L3MBTL1 (0.32) MEP1B

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 TAS1R3 4361/4885TAS1R1 4355/4885MEP1B 2906/4885

“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.

Send feedback