SCHEMBL24786580

SCHEMBL24786580

Fc1cccc(Oc2cc(C(F)(F)F)ncn2)c1-c1cc(C(F)(F)F)on1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 2/20 0.35
▸ FEN1 P39748 2/20 0.35
▸ BLM P54132 1/20 0.33
▸ RAF1 P04049 2/20 0.32
▸ MAPK3 P27361 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.32
▸ MRGPRX1 Q96LB2 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
SCHEMBL23248032 0.89 RAF1 (0.32) RAF1MAPK3MRGPRX1
SCHEMBL24786963 0.89 HDAC1 (0.35) RAF1MAPK3
SCHEMBL24786950 0.89 KDR (0.37) ALOX5APFEN1RAF1MAPK3MRGPRX1
SCHEMBL24786226 0.88 HDAC1 (0.41) ALOX5APFEN1RAF1MAPK3MRGPRX1
SCHEMBL16915398 0.77 L3MBTL1 (0.34) —
SCHEMBL31532186 0.77 L3MBTL1 (0.34) —
SCHEMBL24786258 0.77 HDAC1 (0.35) ALOX5APFEN1SLC6A2SLC6A4SLC6A3
SCHEMBL23795191 0.76 HPGD (0.38) —
SCHEMBL31149018 0.76 HPGD (0.38) —
SCHEMBL30865020 0.73 ALOX5AP (0.46) ALOX5APFEN1RAF1MAPK3MRGPRX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220400676-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-12-22 — — 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-20220400676-A1 HERBICIDAL COMPOUNDS DDT, NQO2, CBR3 ALOX5AP 3161/4885FEN1 3018/4885BLM 2176/4885

“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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