SCHEMBL12557371

SCHEMBL12557371

COC(=O)NOc1cc(/C(C)=N/OCc2ccccc2S(C)(=O)=O)ccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ADRA1D P25100 4/20 0.41
▸ ADRA1A P35348 2/20 0.40
▸ ADRA1B P35368 2/20 0.40
▸ PPARG P37231 4/20 0.39
▸ PPARA Q07869 4/20 0.39
▸ HDAC8 Q9BY41 2/20 0.39
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PTGS2 P35354 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CASP3 P42574 1/20 0.34

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
SCHEMBL12557349 0.89 HDAC8 (0.50) KMT2APPARGPPARAHDAC8NPC1
SCHEMBL12557354 0.87 HDAC8 (0.41) KMT2APPARGPPARAHDAC8NPC1
SCHEMBL12557365 0.87 PPARG (0.42) MEN1CYP1A2CYP3A4CYP2C19KMT2A
SCHEMBL12557364 0.86 PPARG (0.39) MEN1KMT2APPARGPPARAHDAC8
SCHEMBL12557276 0.86 PPARG (0.42) PPARGPPARAHDAC8NPC1RAB9A
SCHEMBL12557369 0.86 HDAC8 (0.43) KMT2APPARGPPARAHDAC8NPC1
SCHEMBL12557289 0.86 POLB (0.42) MEN1KMT2APPARGPPARAHDAC8
SCHEMBL12557387 0.85 KMT2A (0.41) MEN1KMT2APPARGPPARAHDAC8
SCHEMBL12557348 0.84 NPC1 (0.49) PPARGPPARANPC1RAB9AS1PR1
SCHEMBL12557285 0.84 S1PR1 (0.43) PPARGPPARAHDAC8NPC1RAB9A

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
US-20110144374-A1 OXIME ETHER DERIVATIVE AND FUNGICIDE FOR AGRICULTURE AND HORTICULTURE NIPPON SODA CO., LTD. (JP) 2011-06-16 — — US disclosed
US-20110144374-A1 OXIME ETHER DERIVATIVE AND FUNGICIDE FOR AGRICULTURE AND HORTICULTURE NIPPON SODA CO., LTD. (JP) 2011-06-16 — — 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-20110144374-A1 OXIME ETHER DERIVATIVE AND FUNGICIDE FOR AGRICULTURE AND HORTICULTURE CBR3, CNPY2, NOX3 MEN1 1231/4885CYP1A2 11/4885CYP3A4 55/4885

“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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