SCHEMBL4056262

SCHEMBL4056262

COc1ccc2c(c1)c(C=O)c1n2CCN(C)C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
HSD17B10 Q99714 2/20 0.49
HPGD P15428 4/20 0.47
HIF1A Q16665 1/20 0.47
PTGER4 P35408 1/20 0.40
ALDH1A1 P00352 3/20 0.39
MAOA P21397 1/20 0.39
MAPK1 P28482 1/20 0.39
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
MTNR1A P48039 3/20 0.38
MTNR1B P49286 3/20 0.38
HTT P42858 2/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL3950914 0.86 KDM4E (0.41) KDM4EHSD17B10HPGDHIF1APTGER4
SCHEMBL4048350 0.79 CDK5 (0.47) KDM4EHSD17B10HPGDPTGER4ALDH1A1
SCHEMBL4047891 0.79 NQO2 (0.42) KDM4EHSD17B10HPGDHIF1APTGER4
SCHEMBL4053464 0.76 MTNR1A (0.55) KDM4EHSD17B10HPGDHIF1APTGER4
SCHEMBL4056452 0.75 PIK3CA (0.68)
SCHEMBL4048331 0.73 HTR6 (0.52) KDM4EHSD17B10PTGER4ALDH1A1MAPK1
SCHEMBL6642682 0.72 HTR6 (0.57) KDM4EHSD17B10PTGER4ALDH1A1MAPK1
SCHEMBL6642384 0.71 HTR6 (0.56) KDM4EHPGDPTGER4ALDH1A1MTNR1A
SCHEMBL13743682 0.71 MTNR1A (0.43) KDM4EHSD17B10HPGDHIF1APTGER4
SCHEMBL7603198 0.70 ALDH1A1 (0.65) KDM4EHSD17B10HPGDALDH1A1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009097515-A2 [A]-FUSED INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-08-06 WO disclosed
WO-2009097515-A2 [A]-FUSED INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-08-06 WO disclosed
US-20090192147-A1 [a]-FUSED INDOLE COMPOUNDS, THEIR USE AS mTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-07-30 US disclosed
US-20090192147-A1 [a]-FUSED INDOLE COMPOUNDS, THEIR USE AS mTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-07-30 US disclosed
US-20090192147-A1 [a]-FUSED INDOLE COMPOUNDS, THEIR USE AS mTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-07-30 US 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-20090192147-A1 [a]-FUSED INDOLE COMPOUNDS, THEIR USE AS mTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES MTOR, RICTOR, PIK3C2A KDM4E 1263/4885HSD17B10 1827/4885HPGD 2539/4885

“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.