SCHEMBL21179343

SCHEMBL21179343

CC1(C)COC(c2ccc(C(F)(F)F)c(F)c2Cl)=N1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ATM Q13315 2/20 0.38
HTT P42858 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.32
IL2 P60568 1/20 0.31
CYP2D6 P10635 1/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL31121868 1.00 KDM4E (0.40) KDM4EATMHTTALDH1A1LMNA
SCHEMBL1224772 0.85 KDM4E (0.41) KDM4EATMHTTALDH1A1LMNA
SCHEMBL31121871 0.79 KDM4E (0.35) KDM4EATMHTTALDH1A1LMNA
SCHEMBL21177204 0.79 KDM4E (0.35) KDM4EATMHTTALDH1A1LMNA
SCHEMBL23844379 0.75 KDM4E (0.44) KDM4EATMHTTALDH1A1LMNA
SCHEMBL10746575 0.74 KDM4E (0.51) KDM4EATMHTTALDH1A1LMNA
SCHEMBL420824 0.74 KDM4E (0.38) KDM4EATMHTTALDH1A1LMNA
SCHEMBL424180 0.74 KDM4E (0.38) KDM4EATMHTTALDH1A1LMNA
SCHEMBL1223405 0.72 LMNA (0.55) KDM4EHTTLMNAMAPTIL2
SCHEMBL9089149 0.71 HTT (0.42) KDM4EATMHTTALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3740470-B1 AMIDINE SUBSTITUTED BENZOYL DERIVATIVES USEFUL AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2022-05-18 EP disclosed
US-11272709-B2 Amidine substituted benzoyl derivatives useful as herbicides SYNGENTA PARTICIPATIONS AG (CH) 2022-03-15 US disclosed
EP-3740470-A1 AMIDINE SUBSTITUTED BENZOYL DERIVATIVES USEFUL AS HERBICIDES Syngenta Crop Protection AG (CH) 2020-11-25 EP disclosed
US-20200345009-A1 Amidine Substituted Benzoyl Derivatives Useful As Herbicides SYNGENTA PARTICIPATIONS AG (CH) 2020-11-05 US disclosed
CN-111615508-A Amidine substituted benzoyl derivatives useful as herbicides 先正达参股股份有限公司 2020-09-01 CN disclosed
WO-2019141740-A1 AMIDINE SUBSTITUTED BENZOYL DERIVATIVES USEFUL AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2019-07-25 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-11272709-B2 Amidine substituted benzoyl derivatives useful as herbicides GLRX3, DDT, BROX KDM4E 548/4885ATM 3889/4885HTT 1421/4885
US-20200345009-A1 Amidine Substituted Benzoyl Derivatives Useful As Herbicides GLRX3, DDT, BROX KDM4E 548/4885ATM 3889/4885HTT 1421/4885

“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.