SCHEMBL3073580

SCHEMBL3073580

N#Cc1cncc(-c2cccc3[nH]ccc23)c1N

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.46
PRKCQ Q04759 16/20 0.45
PRKCD Q05655 12/20 0.45
PIK3CB P42338 2/20 0.40
PIK3CG P48736 1/20 0.40
DHFR P00374 1/20 0.40

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
SCHEMBL7096071 0.76 IMPDH2 (0.49) PIK3CDPRKCQPRKCDPIK3CBPIK3CG
SCHEMBL29709559 0.76 PIK3CD (0.44) PIK3CDPIK3CBPIK3CGDHFR
SCHEMBL3726444 0.74 PRKCQ (0.46) PIK3CDPRKCQPRKCD
SCHEMBL2979788 0.74 PRKCQ (0.77) PRKCQPRKCD
SCHEMBL1146448 0.73 PRKCQ (0.60) PRKCQPRKCD
SCHEMBL3073584 0.73 ATR (0.47) PIK3CDPRKCQPRKCDPIK3CBPIK3CG
SCHEMBL3304532 0.73 PIK3CD (0.44) PIK3CDPIK3CBPIK3CGDHFR
SCHEMBL20540332 0.72 PIK3CD (0.64) PIK3CDPIK3CBPIK3CGDHFR
SCHEMBL29709511 0.71 ASH1L (0.50) PIK3CDPRKCQPRKCDPIK3CBPIK3CG
SCHEMBL2126661 0.71 PRKCQ (0.43) PRKCQPRKCD

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-7781591-B2 Substituted 3-cyanopyridines as protein kinase inhibitors WYETH LLC (US) 2010-08-24 US disclosed
US-20070287708-A1 Substituted 3-cyanopyridines as protein kinase inhibitors WYETH LLC 2007-12-13 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-20070287708-A1 Substituted 3-cyanopyridines as protein kinase inhibitors CNKSR1, MAP3K1, MAP3K7 PIK3CD 674/4885PRKCQ 165/4885PRKCD 323/4885

“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.