SCHEMBL11902835

SCHEMBL11902835

O=C(O)c1nc(-c2ccc(Cl)c(F)c2)nc2c1ccn2Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 2/20 0.40
▸ HDAC1 Q13547 6/20 0.40
▸ HDAC2 Q92769 3/20 0.40
▸ PTGER4 P35408 1/20 0.39
▸ HDAC6 Q9UBN7 4/20 0.38
▸ KMO O15229 2/20 0.38
▸ ICMT O60725 1/20 0.38
▸ FGFR1 P11362 1/20 0.38
▸ FGFR4 P22455 1/20 0.38
▸ NOTUM Q6P988 1/20 0.38
▸ MDM2 Q00987 1/20 0.37
▸ HDAC4 P56524 2/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ RARA P10276 1/20 0.37
▸ RARB P10826 1/20 0.37
▸ RARG P13631 1/20 0.37
▸ LMNA P02545 1/20 0.36

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
SCHEMBL11903226 0.89 HDAC1 (0.39) HDAC1HDAC2PTGER4HDAC6FGFR1
SCHEMBL11903040 0.86 KMO (0.39) HDAC1HDAC6KMOFGFR1FGFR4
SCHEMBL11903413 0.85 ALDH1A1 (0.39) HDAC1HDAC6HDAC4GAA
SCHEMBL11902957 0.82 NOTUM (0.40) PTGER4KMONOTUMMDM2GAA
SCHEMBL11903049 0.76 GAA (0.41) GAATSHRLMNA
SCHEMBL11903405 0.76 PDE4D (0.37) HDAC1HDAC6FGFR1FGFR4HDAC4
SCHEMBL11902550 0.76 HTT (0.45) HDAC1HDAC6HDAC4GAA
SCHEMBL11902630 0.73 GRM2 (0.37) PTGER4ICMTPDE4D
SCHEMBL11902325 0.71 ALDH1A1 (0.40) GAATSHRLMNA
SCHEMBL11903120 0.71 PPARD (0.38) —

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 EGLN1 290/4885HDAC1 1737/4885HDAC2 922/4885

“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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