SCHEMBL29638152

SCHEMBL29638152

COc1cc(OC)nc(Sc2cccc(Cl)c2C(=O)O/N=C(\C)c2cccc(F)c2)n1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
PKM P14618 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 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
SCHEMBL22954807 1.00 NPC1 (0.37) NPC1RAB9APKMMEN1ALDH1A1
SCHEMBL22955348 0.91 CA12 (0.43) RAB9A
SCHEMBL23665983 0.90 MAPT (0.45) PKM
SCHEMBL22955321 0.90 NPC1 (0.43) NPC1RAB9APKM
SCHEMBL29638148 0.90 NPC1 (0.43) NPC1RAB9APKM
SCHEMBL22954799 0.88 KMT2A (0.46) NPC1RAB9AMEN1ALDH1A1KMT2A
SCHEMBL29638150 0.88 KMT2A (0.46) NPC1RAB9AMEN1ALDH1A1KMT2A
SCHEMBL22954803 0.87 CYP1A2 (0.41)
SCHEMBL23666469 0.85 LMNA (0.33)
SCHEMBL22954806 0.85 NPC1 (0.46) NPC1RAB9APKMMEN1ALDH1A1

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
CN-110317177-B Preparation method of pyrimidine salicylic acid oxime ester compound and application of pyrimidine salicylic acid oxime ester compound as herbicide 常州大学 2022-05-17 CN claimed
US-11834420-B2 Preparation method of pyrimidinylthio-benzoate oxime ester compound and application thereof as herbicide Changzhou University (CN) 2023-12-05 US disclosed
CN-110317177-B Preparation method of pyrimidine salicylic acid oxime ester compound and application of pyrimidine salicylic acid oxime ester compound as herbicide 常州大学 2022-05-17 CN 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-11834420-B2 Preparation method of pyrimidinylthio-benzoate oxime ester compound and application thereof as herbicide ADH1C, ADH1A, AQP4 NPC1 4763/4885RAB9A 4538/4885PKM 520/4885

“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.