SCHEMBL10029802

SCHEMBL10029802

CCN(C)C(=O)c1c[nH]c2ncc(N)cc12

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 9/20 0.46
CYP3A4 P08684 4/20 0.46
ABL1 P00519 1/20 0.46
BRAF P15056 4/20 0.41
AXL P30530 5/20 0.39
AAK1 Q2M2I8 1/20 0.35
SPR P35270 1/20 0.35

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
SCHEMBL9906850 0.80 CYP3A4 (0.40) MAP4K1CYP3A4ABL1BRAFAXL
SCHEMBL10029796 0.79 PIK3CA (0.47) MAP4K1CYP3A4ABL1AXLAAK1
SCHEMBL10029804 0.73 KDM4E (0.36) SPR
SCHEMBL1772956 0.69 MAP3K11 (0.39) MAP4K1CYP3A4ABL1BRAF
SCHEMBL9906846 0.69 JAK2 (0.39) MAP4K1CYP3A4ABL1AXL
SCHEMBL30735555 0.69 MAP4K1 (0.41) MAP4K1CYP3A4ABL1BRAFSPR
SCHEMBL18720827 0.69 JAK3 (0.42)
SCHEMBL14197017 0.69 CYP2D6 (0.43) MAP4K1CYP3A4ABL1
SCHEMBL1772830 0.67 KIT (0.39)
SCHEMBL10269012 0.67 MET (0.43) AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106069-B2 Pyrrolo[2,3-b]pyridine derivatives active as kinase inhibitors and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2012-01-31 US disclosed
US-20100210476-A1 Pyrrolo[2,3-b]Pyridine Derivatives Active as Kinase Inhibitors and Pharmaceutical Compositions Comprising Them PFIZER ITALIA S.R.L. (IT) 2010-08-19 US disclosed
US-7728140-B2 Pyrrolo[2,3-b]pyridine derivatives active as kinase inhibitors and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2010-06-01 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-20100210476-A1 Pyrrolo[2,3-b]Pyridine Derivatives Active as Kinase Inhibitors and Pharmaceutical Compositions Comprising Them MAP3K6, MAP3K3, MAP3K1 MAP4K1 20/4885CYP3A4 3832/4885ABL1 395/4885

“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.