SCHEMBL8241257

SCHEMBL8241257

CN(C)c1cccc(Nc2nccn3c(-c4cn(C)nc4-c4cccc(NC(=O)OC(C)(C)C)c4)cnc23)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.43
▸ FYN P06241 2/20 0.40
▸ AURKA O14965 1/20 0.38
▸ SYK P43405 1/20 0.36
▸ BRAF P15056 1/20 0.36
▸ CYP17A1 P05093 1/20 0.35
▸ TTK P33981 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ SRC P12931 1/20 0.34
▸ PTK6 Q13882 1/20 0.34
▸ JAK2 O60674 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ PTK2 Q05397 1/20 0.33
▸ BTK Q06187 1/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ BCR P11274 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ FGFR3 P22607 1/20 0.32

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
SCHEMBL14538580 0.89 FYN (0.43) BRD4FYNAURKABRAFTTK
SCHEMBL8239650 0.87 TTK (0.44) FYNAURKASYKBRAFTTK
SCHEMBL14536734 0.86 FYN (0.46) FYNAURKABRAFTTKEGFR
SCHEMBL8426780 0.85 FYN (0.47) FYNAURKABRAFTTKEGFR
SCHEMBL8241264 0.84 FYN (0.46) FYNAURKASYKTTKEGFR
SCHEMBL14537088 0.83 FYN (0.45) BRD4FYNAURKASYKBRAF
SCHEMBL12473556 0.78 FYN (0.47) BRD4FYNAURKATTKEGFR
SCHEMBL8240815 0.77 FYN (0.44) BRD4FYNAURKATTKIRAK4
SCHEMBL8241294 0.77 FYN (0.44) BRD4FYNAURKATTKEGFR
SCHEMBL8239882 0.73 AURKA (0.63) FYNAURKATTKEGFRPTK6

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
US-7576085-B2 Imidazopyrazines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2009-08-18 — — US disclosed
WO-2007058942-A2 IMIDAZOPYRAZINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2007-05-24 — — WO disclosed
US-20070117804-A1 Imidazopyrazines as protein kinase inhibitors SCHERING CORPORATION 2007-05-24 — — US disclosed
WO-2007058873-A2 IMIDAZOPYRAZINES AS CYCLIN DEPENTEND KINASE INHIBITORS SCHERING CORPORATION (US) 2007-05-24 — — WO disclosed
US-20070117804-A1 Imidazopyrazines as protein kinase inhibitors SCHERING CORPORATION 2007-05-24 — — US disclosed
WO-2007056468-A1 METHODS FOR INHIBITING PROTEIN KINASES SCHERING CORPORATION (US) 2007-05-18 — — WO disclosed
US-20070105864-A1 Methods for inhibiting protein kinases SCHERING CORPORATION 2007-05-10 — — US disclosed
US-20060106023-A1 Novel imidazopyrazines as cyclin dependent kinase inhibitors SCHERING CORPORATION 2006-05-18 — — 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 (3 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-20060106023-A1 Novel imidazopyrazines as cyclin dependent kinase inhibitors CDK2, CDKN1A, CDK1 BRD4 200/4885FYN 1797/4885AURKA 91/4885
US-20070117804-A1 Imidazopyrazines as protein kinase inhibitors CHEK1, CHEK2, CDKN1A BRD4 474/4885FYN 655/4885AURKA 41/4885
US-20070105864-A1 Methods for inhibiting protein kinases PIM1, PIM2, PIM3 BRD4 755/4885FYN 334/4885AURKA 5/4885

“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.

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