SCHEMBL8248043

SCHEMBL8248043

Cn1cc(-c2cnc3c(Nc4ccc(-n5ccnc5)cc4)nc(C4CCCN(C(=O)OC(C)(C)C)C4)cn23)cn1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.44
▸ GPR119 Q8TDV5 2/20 0.41
▸ IRAK1 P51617 1/20 0.41
▸ USP30 Q70CQ3 1/20 0.40
▸ PTK6 Q13882 5/20 0.39
▸ AURKA O14965 2/20 0.39
▸ LCK P06239 4/20 0.38
▸ AURKB Q96GD4 4/20 0.38
▸ FGFR3 P22607 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ BTK Q06187 2/20 0.36
▸ CCNA2 P20248 1/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ TTK P33981 1/20 0.36
▸ JAK2 O60674 2/20 0.36
▸ JAK3 P52333 2/20 0.36
▸ PTK2 Q05397 2/20 0.36
▸ EGFR P00533 1/20 0.36
▸ MET P08581 1/20 0.36

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
SCHEMBL8240986 0.83 AURKA (0.41) PIK3CDGPR119USP30PTK6AURKA
SCHEMBL8241447 0.80 CHEK1 (0.44) PTK6AURKAAURKBCCNA2CDK2
SCHEMBL14529984 0.80 CHEK1 (0.44) PTK6AURKAAURKBCCNA2CDK2
SCHEMBL11931565 0.80 CHEK1 (0.52) PIK3CDGPR119IRAK1CCNA2CDK2
SCHEMBL8248254 0.80 AURKB (0.53) PTK6AURKALCKAURKB
SCHEMBL8248056 0.80 AURKA (0.54) AURKALCKAURKBKDR
SCHEMBL8247421 0.78 IRAK1 (0.43) PIK3CDGPR119IRAK1USP30FGFR3
SCHEMBL8240994 0.77 IRAK1 (0.42) GPR119IRAK1USP30FGFR3KDR
SCHEMBL14507481 0.76 TTK (0.40) PIK3CDPTK6AURKALCKAURKB
SCHEMBL8250953 0.76 AURKA (0.47) PTK6AURKALCKAURKB

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-7576085-B2 Imidazopyrazines as cyclin dependent kinase inhibitors SCHERING CORPORATION (US) 2009-08-18 — — US disclosed
US-20070117804-A1 Imidazopyrazines as protein kinase inhibitors SCHERING CORPORATION 2007-05-24 — — US 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 PIK3CD 192/4885GPR119 1703/4885IRAK1 410/4885
US-20070117804-A1 Imidazopyrazines as protein kinase inhibitors CHEK1, CHEK2, CDKN1A PIK3CD 283/4885GPR119 2147/4885IRAK1 178/4885
US-20070105864-A1 Methods for inhibiting protein kinases PIM1, PIM2, PIM3 PIK3CD 532/4885GPR119 4245/4885IRAK1 223/4885

“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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