SCHEMBL5484930

SCHEMBL5484930

CCOC(=O)C(=O)c1cnccc1NC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 3/20 0.42
NAMPT P43490 2/20 0.40
TP53 P04637 1/20 0.40
IDO1 P14902 1/20 0.38
TRPV1 Q8NER1 2/20 0.38
MAP4K1 Q92918 1/20 0.37
ATR Q13535 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL30132796 0.90 CYP17A1 (0.42) CYP17A1NAMPTTP53MAP4K1ATR
SCHEMBL6491640 0.90 CYP17A1 (0.42) CYP17A1NAMPTTP53MAP4K1ATR
SCHEMBL13460756 0.85 TP53 (0.36) CYP17A1TP53
SCHEMBL31547757 0.85 TSHR (0.45) TP53RAB9A
SCHEMBL4255346 0.85 TSHR (0.45) TP53RAB9A
SCHEMBL28764741 0.83 NAMPT (0.44) CYP17A1NAMPTIDO1ATRRAB9A
SCHEMBL14363149 0.81 CYP1A2 (0.51)
SCHEMBL12190376 0.80 NAMPT (0.49) CYP17A1NAMPTIDO1ATRRAB9A
SCHEMBL933049 0.80 KDM4C (0.46) CYP17A1NAMPTIDO1ATRRAB9A
SCHEMBL950258 0.79 ATR (0.53) CYP17A1NAMPTIDO1ATRRAB9A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070299102-A1 Diphenyl Ox-Indol-2-One Compounds and Their Use in the Treatment of Cancer TOPO TARGET A/S (DK) 2007-12-27 US disclosed
US-20070299102-A1 Diphenyl Ox-Indol-2-One Compounds and Their Use in the Treatment of Cancer TOPO TARGET A/S (DK) 2007-12-27 US disclosed
US-20070299102-A1 Diphenyl Ox-Indol-2-One Compounds and Their Use in the Treatment of Cancer TOPO TARGET A/S (DK) 2007-12-27 US disclosed
EP-1734951-A2 DIPHENYL-INDOL-2-ON COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TopoTarget A/S (DK) 2006-12-27 EP disclosed
WO-2005097107-A2 DIPHENYL - INDOL-2-ON COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TOPOTARGET A/S (DK) 2005-10-20 WO disclosed
WO-2005097107-A2 DIPHENYL - INDOL-2-ON COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TOPOTARGET A/S (DK) 2005-10-20 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-20070299102-A1 Diphenyl Ox-Indol-2-One Compounds and Their Use in the Treatment of Cancer MTOR, RICTOR, CDK4 CYP17A1 4006/4885NAMPT 3916/4885TP53 229/4885

“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.