SCHEMBL9955798

SCHEMBL9955798

COc1cc(C2=C(c3cn(CCCOC(=O)C(N)CC(C)C)c4ccccc34)C(=O)NC2=O)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 14/20 1.00
FLT3 P36888 7/20 1.00
KDR P35968 11/20 0.91
QPCT Q16769 4/20 0.51
CAMK2D Q13557 2/20 0.48
PLK4 O00444 1/20 0.47
AURKA O14965 1/20 0.47
SRC P12931 1/20 0.47
FLT4 P35916 1/20 0.47
TEK Q02763 1/20 0.47
PTK2 Q05397 1/20 0.47

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
SCHEMBL18655373 0.95 GSK3B (0.91) GSK3BFLT3KDRQPCTCAMK2D
SCHEMBL9956127 0.95 KDR (1.00) GSK3BFLT3KDRQPCTPLK4
SCHEMBL18655374 0.93 GSK3B (0.87) GSK3BFLT3KDRQPCTPLK4
SCHEMBL18655378 0.92 GSK3B (0.86) GSK3BFLT3KDRQPCTCAMK2D
SCHEMBL18655377 0.91 GSK3B (0.91) GSK3BFLT3KDRQPCTPLK4
SCHEMBL19090416 0.90 GSK3B (0.82) GSK3BFLT3KDRQPCTFLT4
SCHEMBL10069744 0.88 GSK3B (1.00) GSK3BFLT3KDRQPCTCAMK2D
SCHEMBL19070784 0.85 GSK3B (0.81) GSK3BFLT3KDRQPCTFLT4
SCHEMBL22334761 0.85 KDR (0.81) GSK3BFLT3KDRPLK4AURKA
SCHEMBL10070114 0.85 GSK3B (0.73) GSK3BFLT3KDRQPCTCAMK2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655359-B1 CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT Johannes-Gutenberg-Universität Mainz (DE) 2017-03-22 EP disclosed
EP-2655359-B1 CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT Johannes-Gutenberg-Universität Mainz (DE) 2017-03-22 EP disclosed
US-8957103-B2 Conjugated 3-(indolyl)- and 3-(azaindolyl)-4-arylmaleimide compounds and their use in tumor treatment Johannes Gutenberg—Universitat Mainz (DE) 2015-02-17 US disclosed
US-8957103-B2 Conjugated 3-(indolyl)- and 3-(azaindolyl)-4-arylmaleimide compounds and their use in tumor treatment Johannes Gutenberg—Universitat Mainz (DE) 2015-02-17 US disclosed
US-20130345281-A1 CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT JOHANNES GUTENBERG-UNIVERSITAT MAINZ (DE) 2013-12-26 US disclosed
EP-2655359-A1 CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT Johannes-Gutenberg-Universität Mainz (DE) 2013-10-30 EP disclosed
EP-2474541-A1 Conjugated 3-(indolyl)- and 3-(azaindolyl)-4-arylmaleimide compounds and their use in tumor treatment Johannes- Gutenberg-Universität Mainz (DE) 2012-07-11 EP disclosed
EP-2474541-A1 Conjugated 3-(indolyl)- and 3-(azaindolyl)-4-arylmaleimide compounds and their use in tumor treatment Johannes- Gutenberg-Universität Mainz (DE) 2012-07-11 EP disclosed
WO-2012084683-A1 CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT Johannes Gutenberg-Universität Mainz (DE) 2012-06-28 WO disclosed
WO-2012084683-A1 CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT Johannes Gutenberg-Universität Mainz (DE) 2012-06-28 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-20130345281-A1 CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT IDH3A, IDH1, INMT GSK3B 3094/4885FLT3 997/4885KDR 861/4885

“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.