SCHEMBL21187512

SCHEMBL21187512

Fc1ccc(-c2c(-n3nnc4cc(Cl)cc(F)c43)ccnc2Cl)c(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 6/20 0.36
▸ IDO1 P14902 2/20 0.36
▸ TDO2 P48775 2/20 0.36
▸ CNR2 P34972 1/20 0.35
▸ HSD11B1 P28845 1/20 0.33
▸ MAPK14 Q16539 3/20 0.32
▸ MAPK13 O15264 2/20 0.32
▸ MAPK12 P53778 2/20 0.32
▸ MAPK11 Q15759 2/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ NISCH Q9Y2I1 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ HSD17B10 Q99714 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
SCHEMBL21187489 0.86 IDO1 (0.41) IDO1TDO2POLB
SCHEMBL21187475 0.81 HSD11B1 (0.36) GRM2CNR2HSD11B1MAPK14MAPK13
SCHEMBL21187510 0.81 HSD11B1 (0.36) GRM2IDO1TDO2CNR2HSD11B1
SCHEMBL21187511 0.78 IDO1 (0.35) IDO1TDO2
SCHEMBL21187486 0.76 GRM2 (0.38) GRM2IDO1TDO2HSD11B1
SCHEMBL21187456 0.74 MAPK14 (0.36) CNR2HSD11B1MAPK14MAPK13MAPK12
SCHEMBL21187509 0.69 IDO1 (0.40) IDO1TDO2POLB
SCHEMBL21187470 0.68 PTGS1 (0.40) IDO1TDO2MAPK1
SCHEMBL21187570 0.67 NISCH (0.42) GRM2TDO2HSD11B1MAPK14MAPK13
SCHEMBL1074268 0.61 IDO1 (0.49) GRM2IDO1TDO2

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 GRM2 2297/4885IDO1 373/4885TDO2 497/4885

“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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