SCHEMBL12557323

SCHEMBL12557323

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ POLB P06746 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ ALOX5 P09917 1/20 0.39
▸ SPHK2 Q9NRA0 4/20 0.39
▸ SPHK1 Q9NYA1 4/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ UTS2R Q9UKP6 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ ACHE P22303 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
SCHEMBL12557330 0.82 MAOB (0.42) MAPTALDH1A1GAAUTS2REPHX2
SCHEMBL12557285 0.82 S1PR1 (0.43) RAB9AALDH1A1UTS2REPHX2NPC1
SCHEMBL12590038 0.81 MAOB (0.39) MAPTALDH1A1KMT2AGAASPHK2
SCHEMBL12557319 0.81 MAOB (0.39) MAPTALDH1A1KMT2AGAASPHK2
SCHEMBL12557320 0.80 MAOB (0.38) ALDH1A1SPHK2SPHK1UTS2REPHX2
SCHEMBL12590867 0.80 MAOB (0.38) ALDH1A1SPHK2SPHK1UTS2REPHX2
SCHEMBL12557327 0.79 MAOB (0.37) ALDH1A1KMT2ASPHK2SPHK1UTS2R
SCHEMBL12557336 0.74 S1PR1 (0.42) RAB9APOLBSPHK2SPHK1UTS2R
SCHEMBL12557338 0.74 S1PR1 (0.42) ALDH1A1UTS2REPHX2MAOBMAOA
SCHEMBL12557335 0.73 S1PR1 (0.41) MAPTALDH1A1POLBSPHK2SPHK1

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 RAB9A 4323/4885MAPT 4450/4885ALDH1A1 1489/4885

“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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