SCHEMBL1633340

SCHEMBL1633340

CC(C)NC(=O)c1ccc(Nc2ncc3ccc(Oc4ccccc4)cc3n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRAF P15056 11/20 0.56
AURKA O14965 1/20 0.50
PIN1 Q13526 2/20 0.47
HPGDS O60760 1/20 0.46
STK17A Q9UEE5 2/20 0.45
NEK3 P51956 1/20 0.45
LIMK1 P53667 1/20 0.45
NEK5 Q6P3R8 1/20 0.45
MYLK4 Q86YV6 1/20 0.45
BTK Q06187 2/20 0.44
EGFR P00533 1/20 0.44
SYK P43405 1/20 0.44
BLK P51451 1/20 0.44

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
SCHEMBL1633623 0.79 TBK1 (0.51) BRAFAURKAHPGDSSTK17ANEK3
SCHEMBL1633767 0.78 HRH3 (0.53) AURKASTK17ANEK3LIMK1NEK5
SCHEMBL13362845 0.78 STK17A (0.55) BRAFAURKASTK17ANEK3LIMK1
SCHEMBL1634724 0.77 IKBKB (0.62) BRAFAURKA
SCHEMBL1633534 0.77 AURKA (0.56) BRAFAURKASTK17ANEK3LIMK1
SCHEMBL14146531 0.76 STK17A (0.56) BRAFAURKASTK17ANEK3LIMK1
SCHEMBL8738919 0.76 ALDH1A1 (0.64)
SCHEMBL12671670 0.75 STK17A (0.55) BRAFAURKASTK17ANEK3LIMK1
SCHEMBL3319061 0.75 STK17A (0.55) BRAFAURKASTK17ANEK3LIMK1
SCHEMBL21835437 0.75 BRAF (0.56) BRAFPIN1STK17ABTKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed
US-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed
US-7932262-B2 Quinazolines for PDK1 inhibition NOVARTIS AG (CH) 2011-04-26 US disclosed
US-20100048561-A1 QUINAZOLINES FOR PDK1 INHIBITION NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2010-02-25 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-20100048561-A1 QUINAZOLINES FOR PDK1 INHIBITION PDK1, PDK2, PDK3 BRAF 334/4885AURKA 576/4885PIN1 1151/4885

“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.