SCHEMBL11902763

SCHEMBL11902763

C=CC(Nc1nc(-c2ccc(Cl)c(OC)c2F)nc(C(=O)OC)c1Cl)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 2/20 0.34
▸ TP53 P04637 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ MEP1B Q16820 1/20 0.32
▸ LDHA P00338 1/20 0.32
▸ LDHB P07195 1/20 0.32
▸ TAS1R3 Q7RTX0 2/20 0.31
▸ TAS1R1 Q7RTX1 2/20 0.31
▸ TAS1R2 Q8TE23 1/20 0.31
▸ PPARA Q07869 2/20 0.31
▸ PPARG P37231 1/20 0.31
▸ S1PR4 O95977 1/20 0.31
▸ S1PR3 Q99500 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
SCHEMBL11902557 0.86 MEP1B (0.34) ACLYTP53MAPTALDH1A1MEP1B
SCHEMBL11903154 0.84 ACLY (0.34) ACLYTP53MAPTALDH1A1MEP1B
SCHEMBL11902929 0.80 TAS1R3 (0.33) ACLYTP53MAPTALDH1A1MEP1B
SCHEMBL1656975 0.79 MEN1 (0.37) ACLYMAPTALDH1A1MEP1BTAS1R3
SCHEMBL1654721 0.79 CYP1A2 (0.43) MAPTALDH1A1PPARG
SCHEMBL1609808 0.78 MAPT (0.33) ACLYTP53MAPTALDH1A1MEP1B
SCHEMBL117789 0.77 TAS1R3 (0.40) ACLYALDH1A1MEP1BTAS1R3TAS1R1
SCHEMBL11913397 0.76 MEP1B (0.35) ACLYMEP1BTAS1R3TAS1R1
SCHEMBL11913413 0.76 MEN1 (0.38) ACLYTP53MAPTALDH1A1TAS1R3
SCHEMBL2682965 0.75 SMN1; SMN2 (0.40) ACLYMAPTMEP1BTAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — 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-20120202690-A1 HERBICIDAL COMPOUNDS DDT, HAO2, HAAO ACLY 537/4885TP53 3431/4885MAPT 4272/4885

“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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