SCHEMBL21187446

SCHEMBL21187446

Cc1ncnc(-n2cnc3cc(Cl)cc(F)c32)c1-c1ccc(F)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 2/20 0.39
▸ DPP4 P27487 2/20 0.36
▸ PDE2A O00408 3/20 0.34
▸ PDE10A Q9Y233 3/20 0.34
▸ PDE7A Q13946 1/20 0.34
▸ CYP11B2 P19099 2/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ DRD1 P21728 1/20 0.32
▸ PDE6D O43924 1/20 0.32
▸ PDE6A P16499 1/20 0.32
▸ PDE6G P18545 1/20 0.32
▸ PDE6B P35913 1/20 0.32
▸ PDE6C P51160 1/20 0.32
▸ PDE6H Q13956 1/20 0.32
▸ GRM2 Q14416 1/20 0.32
▸ EGFR P00533 1/20 0.31
▸ ERBB2 P04626 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
SCHEMBL21182369 0.94 HSD11B1 (0.39) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL21187445 0.88 DRD1 (0.38) HSD11B1PDE2APTGS1PTGS2DRD1
SCHEMBL21187471 0.85 HSD11B1 (0.39) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL21187459 0.83 DPP4 (0.39) HSD11B1DPP4PDE2APDE10A
SCHEMBL21187499 0.83 DRD1 (0.35) HSD11B1PDE2APDE10APDE7APTGS1
SCHEMBL21187486 0.82 GRM2 (0.38) HSD11B1PDE2APDE10APDE7ADRD1
SCHEMBL21187498 0.78 HSD11B1 (0.39) HSD11B1DPP4PDE2APDE10APDE7A
SCHEMBL21187501 0.77 GRM8 (0.35) PTGS1PTGS2
SCHEMBL21187475 0.76 HSD11B1 (0.36) HSD11B1DPP4PTGS1PTGS2GRM2
SCHEMBL20697945 0.75 HSD11B1 (0.39) HSD11B1DPP4PDE2APDE10APDE7A

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-3740474-B1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2022-01-05 — — EP disclosed
US-20200339543-A1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2020-10-29 — — US disclosed
WO-2019141972-A1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 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 (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-20200339543-A1 AGRICULTURAL CHEMICALS ABAT, BRDT, GABBR1 HSD11B1 930/4885DPP4 282/4885PDE2A 2302/4885

“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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