SCHEMBL21585740

SCHEMBL21585740

Cc1nc(C2CC2)ncc1-c1c(Cl)cccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 7/20 0.38
SRC P12931 6/20 0.38
ABL1 P00519 3/20 0.36
PDE10A Q9Y233 1/20 0.36
EGFR P00533 3/20 0.36
FGFR2 P21802 1/20 0.36
FGFR4 P22455 1/20 0.36
FGFR3 P22607 1/20 0.36
PIK3C3 Q8NEB9 1/20 0.36
BACE1 P56817 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
ADRA1A P35348 1/20 0.34
CDK7 P50613 2/20 0.34
CDK9 P50750 2/20 0.34
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33
MAPK14 Q16539 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
SCHEMBL21585736 0.90 PDE10A (0.39) PDE10A
SCHEMBL19813873 0.85 ABL1 (0.44) ABL1PDE10APIK3C3CDK7CDK9
SCHEMBL22282976 0.73 EED (0.33) ABL1PDE10A
SCHEMBL21585742 0.72 SLC6A3 (0.36) FGFR1SRCABL1EGFRFGFR2
SCHEMBL21314823 0.71 L3MBTL1 (0.37) PDE10APIK3C3
SCHEMBL21808416 0.69 SLC6A3 (0.41) FGFR1ABL1EGFRBACE1BACE2
SCHEMBL27945167 0.69 PDE10A (0.37) PDE10ACDK7CDK9
SCHEMBL19302651 0.69 PDE10A (0.39) PDE10APIK3C3
SCHEMBL25300572 0.67 POLQ (0.40) FGFR1ABL1EGFRBACE1BACE2
SCHEMBL19813831 0.67 ABL1 (0.37) ABL1CDK7CDK9MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11390589-B2 Herbicidally active substituted phenylpyrimidines BAYER AKTIENGESELLSCHAFT (DE) 2022-07-19 US disclosed
US-20210317089-A1 HERBICIDALLY ACTIVE SUBSTITUTED PHENYLPYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 2021-10-14 US disclosed
EP-3802516-A1 HERBICIDALLY ACTIVE SUBSTITUTED PHENYLPYRIMIDINES Bayer Aktiengesellschaft (DE) 2021-04-14 EP disclosed
CN-112513028-A Substituted phenylpyrimidines with herbicidal activity 拜耳公司 2021-03-16 CN disclosed
WO-2019233862-A1 HERBICIDALLY ACTIVE SUBSTITUTED PHENYLPYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 2019-12-12 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-20210317089-A1 HERBICIDALLY ACTIVE SUBSTITUTED PHENYLPYRIMIDINES DDT, DPYD, GSTP1 FGFR1 1056/4885SRC 3704/4885ABL1 942/4885
US-11390589-B2 Herbicidally active substituted phenylpyrimidines DDT, DPYD, GSTP1 FGFR1 1056/4885SRC 3704/4885ABL1 942/4885

“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.