SCHEMBL12557285

SCHEMBL12557285

COC(=O)NOc1cc(/C(C)=N/OCc2ccccc2C(F)(F)F)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 5/20 0.43
▸ MAOB P27338 2/20 0.42
▸ MAOA P21397 1/20 0.42
▸ S1PR3 Q99500 1/20 0.39
▸ PPARG P37231 1/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ UTS2R Q9UKP6 1/20 0.38
▸ EPHX2 P34913 1/20 0.37
▸ NPFFR2 Q9Y5X5 1/20 0.36
▸ ROCK2 O75116 1/20 0.36
▸ ROCK1 Q13464 1/20 0.36
▸ TRPV1 Q8NER1 2/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35

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
SCHEMBL12557336 0.92 S1PR1 (0.42) S1PR1MAOBMAOAS1PR3PPARG
SCHEMBL12557338 0.92 S1PR1 (0.42) S1PR1MAOBMAOAS1PR3PPARG
SCHEMBL12557330 0.91 MAOB (0.42) S1PR1MAOBMAOAHDAC8UTS2R
SCHEMBL12557319 0.90 MAOB (0.39) S1PR1MAOBMAOAHDAC8UTS2R
SCHEMBL12590038 0.90 MAOB (0.39) S1PR1MAOBMAOAHDAC8UTS2R
SCHEMBL12557313 0.90 S1PR1 (0.44) S1PR1MAOBMAOAS1PR3PPARG
SCHEMBL12557282 0.90 S1PR1 (0.44) S1PR1MAOBMAOAS1PR3PPARG
SCHEMBL12557302 0.89 S1PR1 (0.40) S1PR1S1PR3NPFFR2LMNA
SCHEMBL12557303 0.89 S1PR1 (0.42) S1PR1S1PR3EPHX2NPFFR2
SCHEMBL12557349 0.88 HDAC8 (0.50) MAOBMAOAPPARGPPARAHDAC8

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 S1PR1 1178/4885MAOB 895/4885MAOA 702/4885

“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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