SCHEMBL17164164

SCHEMBL17164164

Fc1[c]c(OCC2CCCCC2)ccc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 2/20 0.40
▸ TLR4 O00206 1/20 0.39
▸ TLR2 O60603 1/20 0.39
▸ PARP10 Q53GL7 2/20 0.39
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39
▸ ALOX5AP P20292 1/20 0.38
▸ FEN1 P39748 1/20 0.38
▸ PARP15 Q460N3 1/20 0.38

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
SCHEMBL17164203 0.98 MCHR1 (0.38) MCHR1TLR4TLR2PARP10MAOA
SCHEMBL17164084 0.95 MCHR1 (0.38) MCHR1TLR4TLR2PARP10MAOA
SCHEMBL16970011 0.92 TLR4 (0.35) TLR4TLR2PARP10ALOX5APFEN1
SCHEMBL17164177 0.77 PARP10 (0.39) TLR4TLR2PARP10MAOAMAOB
SCHEMBL17164204 0.77 PARP10 (0.45) PARP10MAOAMAOBALOX5APFEN1
SCHEMBL17164159 0.75 PARP10 (0.43) PARP10MAOAMAOBALOX5APFEN1
SCHEMBL17164165 0.75 PARP10 (0.37) TLR4TLR2PARP10MAOAMAOB
SCHEMBL17164169 0.75 MCHR1 (0.36) MCHR1
SCHEMBL17164176 0.74 PARP10 (0.45) PARP10MAOAMAOBPARP15
SCHEMBL1986158 0.73 MCHR1 (0.41) MCHR1PARP10MAOAMAOBPARP15

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 10 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
US-20170022170-A1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES BASF SE (DE) 2017-01-26 — — US 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 MCHR1 2179/4885TLR4 4043/4885TLR2 1401/4885
US-20170022170-A1 DIAMINOTRIAZINE DERIVATIVES AS HERBICIDES DDT, CBR3, HDHD5 MCHR1 2179/4885TLR4 4043/4885TLR2 1401/4885

“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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