SCHEMBL4385542

SCHEMBL4385542

O=S(=O)(c1ccccn1)N1CCC(=NOC(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ PKM P14618 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ PKLR P30613 1/20 0.39
▸ SLC6A2 P23975 2/20 0.38
▸ SLC6A4 P31645 2/20 0.38
▸ SLC6A3 Q01959 2/20 0.38
▸ PTGDR2 Q9Y5Y4 1/20 0.38
▸ POLB P06746 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CNR1 P21554 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ FABP1 P07148 1/20 0.35
▸ HSD11B1 P28845 1/20 0.34

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 0.81 PKM (0.49) KDM4ELMNAPKMGAAPOLB
SCHEMBL4382549 0.81 TP53 (0.46) LMNAPKMPOLB
SCHEMBL4384838 0.81 FABP1 (0.57) GAAFABP1
SCHEMBL4388922 0.80 L3MBTL1 (0.44) KDM4EPKMGAAPTGDR2POLB
SCHEMBL4377766 0.79 NR3C1 (0.40) KDM4ELMNAPKMCYP2C9MEN1
SCHEMBL4378960 0.79 PKM (0.43) KDM4EPKMPKLRCNR1
SCHEMBL4392624 0.78 GAA (0.40) KDM4ELMNAPKMGAAPKLR
SCHEMBL4377015 0.78 PKM (0.46) KDM4ELMNAPKMGAAMEN1
SCHEMBL4382795 0.78 THRB (0.43) PKMPTGDR2POLBMEN1KMT2A
SCHEMBL4393768 0.78 KMT2A (0.47) PKMGAAPKLRCYP2C9MEN1

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 KDM4E 560/4885LMNA 3822/4885PKM 2106/4885

“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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