SCHEMBL4393934

SCHEMBL4393934

COc1ccc(S(=O)(=O)N2CCC(=NOC(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.58
▸ GPBAR1 Q8TDU6 1/20 0.52
▸ GAA P10253 1/20 0.48
▸ LMNA P02545 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ TSHR P16473 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ USP2 O75604 1/20 0.48
▸ GLA P06280 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ ALDH1A1 P00352 5/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ HTT P42858 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ KMT2A Q03164 1/20 0.44

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
SCHEMBL4381279 0.87 PKM (0.49) PKMGAALMNAMAPTALDH1A1
SCHEMBL4391478 0.86 PKM (0.52) PKMGAALMNASMN1; SMN2TSHR
SCHEMBL4385228 0.85 PKM (0.44) PKMGAALMNASMN1; SMN2TSHR
SCHEMBL4382855 0.84 KMT2A (0.52) LMNASMN1; SMN2TSHRMAPTUSP2
SCHEMBL4392624 0.83 GAA (0.40) PKMGAALMNAMAPTMAPK1
SCHEMBL4377015 0.83 PKM (0.46) PKMGAALMNASMN1; SMN2TSHR
SCHEMBL4393768 0.83 KMT2A (0.47) PKMGAASMN1; SMN2KMT2A
SCHEMBL4382575 0.81 KMT2A (0.52) PKMGAALMNASMN1; SMN2MAPT
SCHEMBL4391138 0.80 PKM (0.54) PKMGAALMNASMN1; SMN2MAPK1
SCHEMBL4380728 0.80 GAA (0.51) PKMGAAALDH1A1KDM4EKMT2A

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
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 — — US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 — — US disclosed
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 — — 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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 PKM 2106/4885GPBAR1 1429/4885GAA 3245/4885

“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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