SCHEMBL24854032

SCHEMBL24854032

COCCCn1nc(Cl)c2cccc(Oc3ncc(Cl)cn3)c21

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 6/20 0.34
▸ CYP3A4 P08684 4/20 0.34
▸ CYP2C19 P33261 4/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ NR3C1 P04150 2/20 0.33
▸ CYP2C9 P11712 4/20 0.33
▸ TSHR P16473 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HSD17B10 Q99714 3/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ USP2 O75604 2/20 0.32
▸ MPO P05164 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ HPGD P15428 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ CASP7 P55210 1/20 0.30

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
SCHEMBL24854064 0.93 MPO (0.37) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL24854520 0.88 ESR1 (0.38) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL24853577 0.87 ESR1 (0.37) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL24854022 0.86 ESR1 (0.39) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL24853567 0.85 CYP1A2 (0.32) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL24853761 0.85 CYP1A2 (0.34) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL24853776 0.83 CYP1A2 (0.31) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL29814445 0.83 CYP1A2 (0.33) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL23370304 0.83 CYP1A2 (0.33) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1
SCHEMBL24853772 0.83 CYP1A2 (0.34) CYP1A2CYP3A4CYP2C19CYP2D6L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002357-A1 7-PYRIMIDINE-2-YL-OXY-INDAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2023-01-05 — — US 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-20230002357-A1 7-PYRIMIDINE-2-YL-OXY-INDAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES AZI2, PDXK, DPYD CYP1A2 30/4885CYP3A4 856/4885CYP2C19 290/4885

“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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