SCHEMBL4886737

SCHEMBL4886737

N[N+]12C=CN=CC1=C(C1CCC(C(=O)N3CCC(O)C3)CC1)N=C2c1cccc(O)c1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 1/20 0.33
SOS1 Q07889 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
BUB1 O43683 2/20 0.31
TNKS O95271 1/20 0.31
SMYD3 Q9H7B4 1/20 0.30
HSD11B1 P28845 1/20 0.30
ATR Q13535 1/20 0.30

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
SCHEMBL2457647 0.83 IGF1R (0.46) JAK2JAK1
SCHEMBL2463107 0.82 IGF1R (0.46) JAK2JAK1
SCHEMBL2464630 0.81 POLB (0.32) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2459771 0.77 IGF1R (0.51) JAK2JAK1
SCHEMBL2460493 0.77 IGF1R (0.52) JAK2JAK1
SCHEMBL2459666 0.77 IGF1R (0.53) JAK2JAK1
SCHEMBL2459610 0.77 IGF1R (0.53) JAK2JAK1
SCHEMBL2459717 0.76 IGF1R (0.45) JAK2JAK1
SCHEMBL2461612 0.76 IGF1R (0.46) JAK2JAK1
SCHEMBL2459618 0.76 IGF1R (0.46) JAK2JAK1

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-7459554-B2 Imidazopyrazine tyrosine kinase inhibitors OSI PHARMACEUTICALS, INC. (US) 2008-12-02 US disclosed
US-20080227788-A9 IMIDAZOPYRAZINE TYROSINE KINASE INHIBITORS BECK PATRICIA A 2008-09-18 US disclosed
US-20060084654-A1 Imidazopyrazine tyrosine kinase inhibitors ACERTA PHARMA B.V. (NL) 2006-04-20 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 (2 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-20080227788-A9 IMIDAZOPYRAZINE TYROSINE KINASE INHIBITORS IGF1R, IRS1, IGFBP1 MAPK10 499/4885SOS1 2850/4885JAK2 9/4885
US-20060084654-A1 Imidazopyrazine tyrosine kinase inhibitors IGF1R, IRS1, IGFBP1 MAPK10 499/4885SOS1 2850/4885JAK2 9/4885

“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.