SCHEMBL3879451

SCHEMBL3879451

CC(C)(C)c1cc(C(C)(C)C)c2oc(=O)c(C(=O)Nc3ccc(CN)cc3)cc2c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLG P00747 7/20 0.54
KLK1 P06870 7/20 0.54
KLK6 Q92876 6/20 0.54
KLKB1 P03952 1/20 0.54
MAPT P10636 3/20 0.48
TP53 P04637 1/20 0.48
MAOB P27338 3/20 0.47
MAOA P21397 1/20 0.47
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 1/20 0.44
PLEC Q15149 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
F12 P00748 4/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL4517931 0.84 CYP2C9 (0.51) MAPTMAOBMAOAKMT2ARAB9A
SCHEMBL4511096 0.81 MAOB (0.39) PLGKLK1KLK6KLKB1MAPT
SCHEMBL3943062 0.78 MAPT (0.51) MAPTTP53MAOBMAOAMEN1
SCHEMBL28917577 0.77 MAOB (0.51) MAPTTP53MAOBMAOAMEN1
SCHEMBL28075577 0.74 GPR35 (0.56) MAPTTP53MAOBMAOAPOLB
SCHEMBL27951959 0.74 ALDH1A1 (0.48) MAPTTP53MAOBMAOAPOLB
SCHEMBL3882408 0.73 TP53 (0.63) PLGKLK1KLK6KLKB1MAPT
SCHEMBL3881940 0.73 MAOB (0.65) PLGKLK1KLK6KLKB1MAPT
SCHEMBL4510541 0.72 S1PR1 (0.51) PLGKLK1KLK6KLKB1MAPT
SCHEMBL3882446 0.72 MAOA (0.51) PLGKLK1KLK6MAPTTP53

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-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

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 PLG 3868/4885KLK1 875/4885KLK6 2067/4885

“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.