SCHEMBL1677032

SCHEMBL1677032

N#Cc1cccc(C(=O)NOC2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.49
LMNA P02545 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
TP53 P04637 1/20 0.45
SFRP1 Q8N474 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 2/20 0.44
MEN1 O00255 1/20 0.44
NR1I2 O75469 2/20 0.44
CACNA1B Q00975 2/20 0.44
TRPV4 Q9HBA0 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
SCHEMBL1677048 0.92 CNR1 (0.57) CNR1LMNAL3MBTL1TP53SMN1; SMN2
SCHEMBL1677066 0.85 GPR6 (0.48) L3MBTL1SFRP1KMT2AMEN1
SCHEMBL12807416 0.84 KMT2A (0.45) CNR1LMNAL3MBTL1KMT2AMEN1
SCHEMBL1676993 0.84 TP53 (0.58) CNR1LMNAL3MBTL1TP53SMN1; SMN2
SCHEMBL1676917 0.83 CNR1 (0.52) CNR1LMNAL3MBTL1TP53SMN1; SMN2
SCHEMBL1677101 0.80 CNR1 (0.60) CNR1LMNAL3MBTL1TP53SMN1; SMN2
SCHEMBL1677145 0.79 TP53 (0.54) CNR1LMNAL3MBTL1TP53SMN1; SMN2
SCHEMBL1677110 0.79 TP53 (0.54) CNR1LMNAL3MBTL1TP53SMN1; SMN2
SCHEMBL1677109 0.79 TP53 (0.54) CNR1LMNAL3MBTL1TP53SMN1; SMN2
SCHEMBL1677199 0.78 HTT (0.57) CNR1LMNAL3MBTL1TP53SMN1; SMN2

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-8518934-B2 Oxycarbamoyl compounds and the use thereof SHONOGI & CO., LTD. (JP) 2013-08-27 US disclosed
US-20110098276-A1 OXYCARBAMOYL COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2011-04-28 US disclosed
US-20110098276-A1 OXYCARBAMOYL COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2011-04-28 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-20110098276-A1 OXYCARBAMOYL COMPOUNDS AND THE USE THEREOF CACNA1B, ORAI1, CACNA1I CNR1 65/4885LMNA 2932/4885L3MBTL1 3054/4885

“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.