SCHEMBL4393768

SCHEMBL4393768

O=S(=O)(c1cccc(F)c1)N1CCC(=NOC(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ GFER P55789 1/20 0.47
▸ GPR183 P32249 1/20 0.45
▸ PKM P14618 2/20 0.45
▸ PKLR P30613 1/20 0.45
▸ HTR2A P28223 1/20 0.43
▸ HTR2C P28335 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ CYP2C9 P11712 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ GAA P10253 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ AKR1C3 P42330 1/20 0.40

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
SCHEMBL4380728 0.90 GAA (0.51) KMT2AMEN1GPR183PKMCYP2C9
SCHEMBL4392624 0.90 GAA (0.40) KMT2AMEN1PKMPKLRCYP2C9
SCHEMBL4384919 0.88 HTT (0.48) PKMPKLRSMN1; SMN2GAA
SCHEMBL4381279 0.88 PKM (0.49) KMT2AMEN1PKMCYP2C9GAA
SCHEMBL4377730 0.87 GPR183 (0.41) KMT2AMEN1GPR183PKMCYP2C9
SCHEMBL4380268 0.87 SCN9A (0.47) PKMCYP2C9GAAAKR1C3
SCHEMBL4386137 0.87 GAA (0.53) KMT2AMEN1SMN1; SMN2CYP2C9GAA
SCHEMBL4391227 0.87 SCN9A (0.47) KMT2AMEN1GPR183PKMCYP2C9
SCHEMBL4385228 0.86 PKM (0.44) KMT2AMEN1PKMPKLRSMN1; SMN2
SCHEMBL4387410 0.85 KMT2A (0.53) KMT2AMEN1SMN1; SMN2CYP2C9GAA

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 4 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
WO-2008008398-A2 OXIME COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2008-01-17 — — WO 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 KMT2A 2079/4885MEN1 3694/4885GFER 269/4885

“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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