SCHEMBL12557303

SCHEMBL12557303

COC(=O)NOc1cc(/C(C)=N/OCc2ccc(F)cc2C(F)(F)F)ccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 11/20 0.42
▸ S1PR3 Q99500 8/20 0.41
▸ IDO1 P14902 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ EPHX2 P34913 1/20 0.37
▸ NPFFR2 Q9Y5X5 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ S1PR4 O95977 1/20 0.35
▸ S1PR5 Q9H228 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
SCHEMBL12557302 0.93 S1PR1 (0.40) S1PR1S1PR3L3MBTL1MAPTTDP1
SCHEMBL12557409 0.90 S1PR1 (0.43) S1PR1S1PR3IDO1EPHX2S1PR4
SCHEMBL12557285 0.89 S1PR1 (0.43) S1PR1S1PR3EPHX2NPFFR2
SCHEMBL12557306 0.89 MAOB (0.42) S1PR1S1PR3L3MBTL1MAPTTDP1
SCHEMBL12557329 0.88 ESRRA (0.37) S1PR1IDO1L3MBTL1MAPTTDP1
SCHEMBL12557293 0.84 S1PR1 (0.47) S1PR1S1PR3MAPT
SCHEMBL12557299 0.83 S1PR1 (0.39) S1PR1S1PR3MAPTNPFFR2POLB
SCHEMBL12557272 0.83 PPARG (0.37) S1PR1S1PR3MAPTPOLB
SCHEMBL12557297 0.83 GRIN2B (0.44) S1PR1S1PR3
SCHEMBL12557289 0.82 POLB (0.42) S1PR1MAPTTDP1POLB

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 1178/4885S1PR3 726/4885IDO1 168/4885

“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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