SCHEMBL20853046

SCHEMBL20853046

CN(C(=O)OC(C)(C)C)c1cnc(-c2cncc(F)c2)nc1C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
ABL1 P00519 11/20 0.33
GPBAR1 Q8TDU6 3/20 0.33
CACNA1G O43497 1/20 0.33
CACNA1B Q00975 1/20 0.33
CACNA1C Q13936 1/20 0.33
ADORA2A P29274 2/20 0.33
ADORA2B P29275 2/20 0.33
P2RX3 P56373 1/20 0.32
PAX8 Q06710 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
SCHEMBL29856005 0.87 ABL1 (0.36) HDAC1HDAC8HDAC6ABL1ADORA2A
SCHEMBL20839182 0.87 ABL1 (0.36) HDAC1HDAC8HDAC6ABL1ADORA2A
SCHEMBL19384230 0.83 IRAK4 (0.35) HDAC1HDAC8HDAC6ABL1GPBAR1
SCHEMBL29725001 0.83 IRAK4 (0.35) HDAC1HDAC8HDAC6ABL1GPBAR1
SCHEMBL20845417 0.83 ABL1 (0.34) ABL1GPBAR1
SCHEMBL22380822 0.80 IDH1 (0.33) ABL1
SCHEMBL19450112 0.79 PAX8 (0.39) HDAC1HDAC8HDAC6ABL1CACNA1G
SCHEMBL20852928 0.79 ABL1 (0.35) ABL1
SCHEMBL20841415 0.77 CYP17A1 (0.39) ABL1
SCHEMBL22372368 0.77 ABL1 (0.34) ABL1

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
EP-3684763-B1 PYRIMIDIN-4-CARBAMATE OR UREA DERIVATIVES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2021-11-17 EP disclosed
US-20200288711-A1 Pyrimidin-4-Carbamate or Urea Derivatives As Herbicides SYNGENTA PARTICIPATIONS AG (CH) 2020-09-17 US disclosed
WO-2019057722-A1 PYRIMIDIN-4-CARBAMATE OR UREA DERIVATIVES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2019-03-28 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 (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-20200288711-A1 Pyrimidin-4-Carbamate or Urea Derivatives As Herbicides PLPBP, DDT, UMPS HDAC1 2220/4885HDAC8 1683/4885HDAC6 1404/4885

“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.