SCHEMBL10070566

SCHEMBL10070566

COc1cc(C2=C(c3cn(CCCNC(=O)C(CC(C)C)NC(=O)OC(C)(C)C)c4ccccc34)C(=O)NC2=O)cc(OC)c1OC

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 12/20 0.75
FLT3 P36888 8/20 0.62
KDR P35968 11/20 0.60
CAMK2D Q13557 3/20 0.55
CDK2 P24941 2/20 0.53
PDPK1 O15530 1/20 0.53
CCNB2 O95067 1/20 0.53
PRKCB P05771 1/20 0.53
CDK1 P06493 1/20 0.53
LYN P07948 1/20 0.53
CCNB1 P14635 1/20 0.53
CCNA2 P20248 1/20 0.53
RPS6KA3 P51812 1/20 0.53
CCNA1 P78396 1/20 0.53
CCNB3 Q8WWL7 1/20 0.53
PLK4 O00444 1/20 0.46
AURKA O14965 1/20 0.46
EGFR P00533 1/20 0.46
ERBB2 P04626 1/20 0.46
INSR P06213 1/20 0.46

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
SCHEMBL10070111 0.93 GSK3B (0.68) GSK3BFLT3KDRCAMK2DCDK2
SCHEMBL10070114 0.90 GSK3B (0.73) GSK3BFLT3KDRCAMK2DCDK2
SCHEMBL10070113 0.89 GSK3B (0.63) GSK3BFLT3KDRCAMK2DCDK2
SCHEMBL10070115 0.88 KDR (0.73) GSK3BFLT3KDRCAMK2DCDK2
SCHEMBL18655336 0.87 GSK3B (0.86) GSK3BFLT3KDRCAMK2DPLK4
SCHEMBL10069744 0.86 GSK3B (1.00) GSK3BFLT3KDRCAMK2DPLK4
SCHEMBL18655375 0.83 GSK3B (0.79) GSK3BFLT3KDRCAMK2DPLK4
SCHEMBL9954914 0.82 GSK3B (0.87) GSK3BFLT3KDRCAMK2DPLK4
SCHEMBL9960978 0.82 GSK3B (0.61) GSK3BFLT3KDRCAMK2DCDK2
SCHEMBL9960974 0.81 KDR (0.61) GSK3BFLT3KDRCAMK2DCDK2

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 8 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-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

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.