SCHEMBL4049833

SCHEMBL4049833

COc1ccc2c(c1)cc1n2CCOC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.58
HTR2C P28335 2/20 0.58
KDM4E B2RXH2 10/20 0.45
ALDH1A1 P00352 9/20 0.45
HPGD P15428 6/20 0.45
HSD17B10 Q99714 4/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 2/20 0.45
TSHR P16473 1/20 0.44
CASP1 P29466 1/20 0.44
PIK3CD O00329 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
PIK3CA P42336 2/20 0.42
USP2 O75604 1/20 0.42
MAPT P10636 2/20 0.41
GAA P10253 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PIK3CB P42338 1/20 0.40
PRKDC P78527 1/20 0.39

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
SCHEMBL16197697 0.79 HTR2A (0.51) HTR2AHTR2CKDM4EALDH1A1POLB
SCHEMBL18527235 0.78 HTR2A (0.56) HTR2AHTR2CKDM4EALDH1A1KMT2A
SCHEMBL18202354 0.77 SIGMAR1 (0.42) HTR2AHTR2CKDM4EALDH1A1HPGD
SCHEMBL4048826 0.77 HTR2A (0.62) HTR2AHTR2CKDM4EALDH1A1HPGD
SCHEMBL8133155 0.77 MAPT (0.38) HTR2AHTR2CKDM4EALDH1A1POLB
SCHEMBL16197695 0.76 HTR2A (0.48) HTR2AHTR2CKDM4EALDH1A1HPGD
SCHEMBL4049250 0.75 HTR2A (0.59) HTR2AHTR2CKDM4EALDH1A1HPGD
SCHEMBL31487256 0.74 HTR2A (0.51) HTR2AHTR2CKDM4ETSHRMAPT
SCHEMBL1520653 0.74 HTR2A (0.51) HTR2AHTR2CKDM4ETSHRMAPT
SCHEMBL970777 0.73 HTR2A (1.00) HTR2AHTR2CKDM4EALDH1A1HPGD

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 HTR2A 780/4885HTR2C 826/4885KDM4E 1263/4885

“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.