SCHEMBL17164069

SCHEMBL17164069

Fc1[c]c(OCC2CCCC2)cc(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 3/20 0.42
▸ PARP15 Q460N3 2/20 0.40
▸ THRA P10827 2/20 0.35
▸ THRB P10828 2/20 0.35
▸ SCN9A Q15858 4/20 0.34
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33

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
SCHEMBL17164129 0.98 PARP10 (0.44) PARP10PARP15THRATHRBSCN9A
SCHEMBL17164201 0.97 PARP10 (0.43) PARP10PARP15THRATHRBALOX5AP
SCHEMBL17164173 0.93 PARP10 (0.35) PARP10PARP15SCN9AALOX5APFEN1
SCHEMBL17164159 0.79 PARP10 (0.43) PARP10PARP15ALOX5APFEN1MAOA
SCHEMBL17164204 0.77 PARP10 (0.45) PARP10PARP15ALOX5APFEN1MAOA
SCHEMBL17164212 0.75 PARP10 (0.43) PARP10PARP15ALOX5APFEN1
SCHEMBL17164165 0.75 PARP10 (0.37) PARP10PARP15THRATHRBMAOA
SCHEMBL17164068 0.75 PTGS1 (0.35) —
SCHEMBL17164177 0.74 PARP10 (0.39) PARP10PARP15THRATHRBALOX5AP
SCHEMBL17164218 0.74 PARP10 (0.42) PARP10PARP15SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10941122-B2 Diaminotriazine derivatives as herbicides BASF SE (DE) 2021-03-09 — — US claimed
EP-3129359-B1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES BASF SE (DE) 2021-03-03 — — EP claimed
EP-3129359-A1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES BASF SE (DE) 2017-02-15 — — EP claimed
WO-2015155272-A1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES BASF SE (DE) 2015-10-15 — — WO claimed
US-10941122-B2 Diaminotriazine derivatives as herbicides BASF SE (DE) 2021-03-09 — — US disclosed
EP-3129359-B1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES BASF SE (DE) 2021-03-03 — — EP disclosed
EP-3129359-A1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES BASF SE (DE) 2017-02-15 — — EP disclosed
US-20170022170-A1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES BASF SE (DE) 2017-01-26 — — US disclosed
WO-2015155272-A1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES BASF SE (DE) 2015-10-15 — — 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 (2 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-10941122-B2 Diaminotriazine derivatives as herbicides DDT, CBR3, HDHD5 PARP10 3343/4885PARP15 2739/4885THRA 897/4885
US-20170022170-A1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES DDT, CBR3, HDHD5 PARP10 3343/4885PARP15 2739/4885THRA 897/4885

“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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