SCHEMBL1428282

SCHEMBL1428282

COc1cccc2c1OC(=Cc1c[nH]c3ccc(Br)cc13)C2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.54
FGFR1 P11362 1/20 0.52
PIK3CA P42336 2/20 0.51
MTOR P42345 2/20 0.51
PIK3CG P48736 2/20 0.51
PIM1 P11309 9/20 0.49
STK17B O94768 1/20 0.46
PIM3 Q86V86 3/20 0.45
IDO1 P14902 1/20 0.43
PIM2 Q9P1W9 1/20 0.41
NTRK1 P04629 2/20 0.41
PDGFRB P09619 2/20 0.41
KDR P35968 2/20 0.41
EGFR P00533 2/20 0.41
ERBB2 P04626 1/20 0.41
IGF1R P08069 1/20 0.41
KIT P10721 1/20 0.41
PDGFRA P16234 1/20 0.41
FLT1 P17948 1/20 0.41
FLT4 P35916 1/20 0.41

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
SCHEMBL4320965 1.00 TYR (0.54) TYRFGFR1PIK3CAMTORPIK3CG
SCHEMBL1429461 0.89 PIK3CA (0.56) TYRPIK3CAMTORPIK3CGPIM1
SCHEMBL4320014 0.89 PIK3CA (0.56) TYRPIK3CAMTORPIK3CGPIM1
SCHEMBL1428201 0.86 PIM1 (0.63) TYRPIK3CAMTORPIM1STK17B
SCHEMBL4321487 0.86 PIM1 (0.63) TYRPIK3CAMTORPIM1STK17B
SCHEMBL1428285 0.82 TYR (0.55) TYRPIM1STK17BPIM3PIM2
SCHEMBL4315267 0.82 TYR (0.55) TYRPIM1STK17BPIM3PIM2
SCHEMBL1428302 0.81 ACHE (0.54) TYRPIK3CAMTORPIK3CGPIM1
SCHEMBL4322450 0.81 ACHE (0.54) TYRPIK3CAMTORPIK3CGPIM1
SCHEMBL1428533 0.79 PIK3CA (0.63) TYRPIK3CAMTORPIK3CGSTK17B

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
EP-2300460-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES Wyeth LLC (US) 2011-03-30 EP claimed
WO-2009155042-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-12-23 WO claimed
US-20090311217-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-12-17 US claimed
EP-2300460-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES Wyeth LLC (US) 2011-03-30 EP disclosed
WO-2009155042-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-12-23 WO disclosed
US-20090311217-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-12-17 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-20090311217-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES MTOR, RICTOR, PDPK1 TYR 490/4885FGFR1 585/4885PIK3CA 4/4885

“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.