SCHEMBL4042357

SCHEMBL4042357

COc1ccc2cc(C(=O)Nc3ccc(C(C)(C)N)cc3)c(=O)oc2c1OC(C)C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.54
TP53 P04637 2/20 0.49
MAPT P10636 1/20 0.49
MAOB P27338 5/20 0.47
MAOA P21397 2/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
HSD17B10 Q99714 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL3882211 0.92 CNR2 (0.52) CNR2TP53MAPTMAOBMAOA
SCHEMBL3883027 0.92 CNR2 (0.54) CNR2TP53MAPTMAOBMAOA
SCHEMBL3882126 0.92 CNR2 (0.54) CNR2TP53MAPTMAOBMAOA
SCHEMBL3883904 0.89 CNR2 (0.58) CNR2TP53MAPTMAOBMAOA
SCHEMBL4532090 0.89 CNR2 (0.59) CNR2TP53MAPTMAOBMAOA
SCHEMBL3879511 0.87 TP53 (0.50) CNR2TP53MAPTMAOBMAOA
SCHEMBL3885786 0.87 CNR2 (0.59) CNR2TP53MAPTMAOBMAOA
SCHEMBL3878869 0.86 TP53 (0.59) CNR2TP53MAPTMAOBMAOA
SCHEMBL4522651 0.86 MAOB (0.59) CNR2TP53MAPTMAOBMAOA
SCHEMBL4522656 0.85 TP53 (0.50) CNR2TP53MAPTMAOBMAOA

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-20090318546-A1 Chromen-2-One Derivatives NOVARTIS AG (CH) 2009-12-24 US claimed
EP-2010511-A1 CHROMEN-2-ONE DERIVATIVES Novartis AG (CH) 2009-01-07 EP claimed
WO-2007115820-A1 CHROMEN-2-ONE DERIVATIVES NOVARTIS AG (CH) 2007-10-18 WO claimed
WO-2009026197-A1 NOVEL CATHEPSIN C INHIBITORS AND THEIR USE GLAXO GROUP LIMITED (GB) 2009-02-26 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-20090318546-A1 Chromen-2-One Derivatives CYP1A2, CYP4B1, CYP1B1 CNR2 538/4885TP53 487/4885MAPT 3872/4885

“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.