SCHEMBL29174205

SCHEMBL29174205

CCOC(=O)/C=C/c1cc(Cl)n(C)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 1/20 0.43
▸ DPP4 P27487 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43
▸ CCNC P24863 2/20 0.42
▸ CDK8 P49336 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAOB P27338 1/20 0.40
▸ XPO1 O14980 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ FDPS P14324 1/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.38
▸ MAPT P10636 4/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ CNKSR1 Q969H4 1/20 0.37

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
SCHEMBL22305028 0.80 PKM (0.45) TTRDPP4CA12CA1CA2
SCHEMBL25232016 0.79 L3MBTL1 (0.49) TTRDPP4CA12CA1CA2
SCHEMBL30492201 0.77 TTR (0.43) TTRDPP4CA12CA1CA2
SCHEMBL14148933 0.74 CA12 (0.49) TTRDPP4CA12CA1CA2
SCHEMBL29788898 0.74 TTR (0.46) TTRDPP4CA12CA1CA2
SCHEMBL26424371 0.72 TTR (0.42) TTRDPP4CA12CA1CA2
SCHEMBL29000262 0.72 TTR (0.42) TTRDPP4CA12CA1CA2
SCHEMBL30404055 0.72 TTR (0.47) TTRDPP4CA12CA1CA2
SCHEMBL25707280 0.72 TTR (0.47) TTRDPP4CA12CA1CA2
SCHEMBL4096954 0.71 TTR (0.47) TTRDPP4CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117700363-A Pyrazole derivatives 先正达农作物保护股份公司 2024-03-15 — — CN claimed
US-11680057-B2 Pyrazole derivatives SYNGENTA CROP PROTECTION AG (CH) 2023-06-20 — — US claimed

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-11680057-B2 Pyrazole derivatives RB1, NQO2, RBX1 TTR 4084/4885DPP4 1556/4885CA12 4426/4885

“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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