SCHEMBL4558459

SCHEMBL4558459

C=CCc1c(OC)ccc2cc(C(=O)Nc3ccc(C(C)(C)N)cc3)c(=O)oc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
KDM4E B2RXH2 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
TP53 P04637 2/20 0.49
S1PR1 P21453 5/20 0.49
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 1/20 0.48
PLEC Q15149 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MAOB P27338 3/20 0.47
MAOA P21397 2/20 0.47
HSD17B10 Q99714 1/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 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
SCHEMBL3882544 0.89 S1PR1 (0.54) MAPTKDM4ETP53S1PR1MAOB
SCHEMBL3880237 0.88 MAPT (0.57) MAPTKDM4ENPC1RAB9ATP53
SCHEMBL3885669 0.87 S1PR1 (0.64) MAPTTP53S1PR1POLBMAOB
SCHEMBL4522656 0.86 TP53 (0.50) MAPTTP53S1PR1MAOBMAOA
SCHEMBL4518093 0.85 S1PR1 (0.58) MAPTTP53S1PR1POLBMAOB
SCHEMBL3950451 0.85 MAPT (0.50) MAPTKDM4ENPC1RAB9ATP53
SCHEMBL3952682 0.85 MAPT (0.51) MAPTKDM4ENPC1RAB9ATP53
SCHEMBL3883450 0.85 S1PR1 (0.52) MAPTKDM4ETP53S1PR1MAOB
SCHEMBL4523523 0.85 MAPT (0.53) MAPTKDM4ENPC1RAB9ATP53
SCHEMBL3878907 0.84 MAPT (0.55) MAPTKDM4ENPC1RAB9ATP53

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 1 patent. 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

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 MAPT 3872/4885KDM4E 2028/4885NPC1 1757/4885

“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.