SCHEMBL4953871

SCHEMBL4953871

CCn1cc(-c2ccnc3[nH]c(C(=O)NN4CCN(C)CC4)cc23)c(-c2ccc(NC(=O)Nc3ccccc3)cc2)n1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AURKA O14965 18/20 0.80
AURKB Q96GD4 18/20 0.80
BRAF P15056 2/20 0.67
LYN P07948 1/20 0.62
IGF1R P08069 1/20 0.62
MET P08581 1/20 0.62
ROCK1 Q13464 1/20 0.62
INCENP Q9NQS7 1/20 0.62

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
SCHEMBL4320216 0.89 AURKA (1.00) AURKAAURKBBRAFLYNIGF1R
SCHEMBL4318549 0.84 AURKA (0.74) AURKAAURKBBRAFLYNIGF1R
SCHEMBL4306979 0.83 AURKA (1.00) AURKAAURKBBRAFLYNIGF1R
SCHEMBL4311938 0.83 AURKA (1.00) AURKAAURKBBRAFLYNIGF1R
SCHEMBL4310822 0.83 AURKA (0.77) AURKAAURKBBRAFLYNIGF1R
SCHEMBL14492827 0.82 AURKA (0.81) AURKAAURKBBRAFLYNIGF1R
SCHEMBL4320221 0.80 AURKA (0.79) AURKAAURKBBRAFLYNIGF1R
SCHEMBL4319404 0.80 AURKA (1.00) AURKAAURKBBRAFLYNIGF1R
SCHEMBL4308221 0.80 AURKA (1.00) AURKAAURKBBRAFLYNIGF1R
SCHEMBL4307090 0.79 AURKA (1.00) AURKAAURKBBRAFLYNIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7419988-B2 Azaindole inhibitors of aurora kinases SMITHKLINE BEECHAM CORP (US) 2008-09-02 US disclosed
US-20080004308-A1 AZAINDOLE INHIBITORS OF AURORA KINASES GLAXOSMITHKLINE LLC 2008-01-03 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-20080004308-A1 AZAINDOLE INHIBITORS OF AURORA KINASES AURKA, AURKC, AURKB AURKA 1/4885AURKB 3/4885BRAF 577/4885

“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.