SCHEMBL5522115

SCHEMBL5522115

CC(C)(CF)NC(=O)c1cc(-c2ccc(NC(=O)OC(C)(C)C)cn2)n(-c2cnccn2)n1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.39
CNR2 P34972 9/20 0.37
CNR1 P21554 9/20 0.37
CYP17A1 P05093 1/20 0.34
BCL2 P10415 1/20 0.34
CFTR P13569 1/20 0.33
ANO1 Q5XXA6 1/20 0.33
SLC5A1 P13866 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
MAPK14 Q16539 1/20 0.32

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
SCHEMBL5518699 0.91 NAMPT (0.42) NAMPTCNR2CNR1CYP17A1BCL2
SCHEMBL5519799 0.88 CNR1 (0.49) NAMPTCNR2CNR1BCL2
SCHEMBL4923338 0.86 NAMPT (0.41) NAMPTCYP17A1BCL2SLC5A1GPR119
SCHEMBL4932007 0.84 NPC1 (0.41) NAMPTCYP17A1BCL2GPR119
SCHEMBL5529763 0.84 CNR1 (0.40) CNR2CNR1
SCHEMBL4932361 0.80 CYP1A2 (0.38) NAMPTBCL2CFTRGPR119
SCHEMBL5524902 0.78 NAMPT (0.48) NAMPTCNR2CNR1CYP17A1BCL2
SCHEMBL5527649 0.76 CNR1 (0.49) NAMPTCNR2CNR1
SCHEMBL5525584 0.74 CNR1 (0.41) CNR2CNR1ANO1
SCHEMBL14270461 0.73 RXFP1 (0.34)

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-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
CN-1902191-A Amidopyrazole derivative DAIICHI SEIYAKU CO (JP) 2007-01-24 CN disclosed
EP-1698626-A1 AMIDOPYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 EP 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-20070219210-A1 Amidopyrazole Derivative PTGER1, PTGS1, PTGER2 NAMPT 2905/4885CNR2 43/4885CNR1 76/4885

“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.