SCHEMBL4002022

SCHEMBL4002022

COc1cc(Nc2nccc(-c3cccc(NC(=O)c4cc(C)on4)c3)n2)cc(OC)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCA P17252 4/20 0.58
▸ ZAP70 P43403 2/20 0.58
▸ PRKD3 O94806 1/20 0.58
▸ PRKCG P05129 1/20 0.58
▸ PRKCB P05771 1/20 0.58
▸ LCK P06239 1/20 0.58
▸ PRKCH P24723 1/20 0.58
▸ PRKCI P41743 1/20 0.58
▸ PRKCE Q02156 1/20 0.58
▸ PRKCQ Q04759 1/20 0.58
▸ PRKCZ Q05513 1/20 0.58
▸ PRKCD Q05655 1/20 0.58
▸ PRKD1 Q15139 1/20 0.58
▸ EGFR P00533 2/20 0.54
▸ JAK2 O60674 1/20 0.54
▸ CDK2 P24941 1/20 0.54
▸ PIK3CA P42336 1/20 0.54
▸ PIK3CB P42338 1/20 0.54
▸ PIK3CG P48736 1/20 0.54
▸ PTK2B Q14289 1/20 0.54

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
SCHEMBL6980016 0.84 PLK1 (0.69) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL3997532 0.82 PRKCA (0.71) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL4733503 0.77 ZAP70 (0.71) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL4903186 0.76 ABL1 (0.75) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL4903101 0.76 ABL1 (0.59) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL5549011 0.76 SMN1; SMN2 (0.61) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL6977138 0.76 ZAP70 (0.73) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL4897378 0.75 ABL1 (0.64) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL6974310 0.75 ZAP70 (0.80) PRKCAZAP70PRKD3PRKCGPRKCB
SCHEMBL6979699 0.75 ZAP70 (0.71) PRKCAZAP70PRKD3PRKCGPRKCB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2069314-A1 PYRIMIDINES DERIVATIVES AND THEIR USE AS KINASE INHIBITORS CGI Pharmaceuticals, Inc. (US) 2009-06-17 — — EP claimed
US-20080125417-A1 CERTAIN PYRIMIDINES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI PHARMACEUTICALS, INC. 2008-05-29 — — US claimed
WO-2008033834-A1 PYRIMIDINES DERIVATIVES AND THEIR USE AS KINASE INHIBITORS CGI PHARMACEUTICALS, INC. (US) 2008-03-20 — — WO claimed
EP-2069314-A1 PYRIMIDINES DERIVATIVES AND THEIR USE AS KINASE INHIBITORS CGI Pharmaceuticals, Inc. (US) 2009-06-17 — — EP disclosed
US-20080125417-A1 CERTAIN PYRIMIDINES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI PHARMACEUTICALS, INC. 2008-05-29 — — US disclosed
WO-2008033834-A1 PYRIMIDINES DERIVATIVES AND THEIR USE AS KINASE INHIBITORS CGI PHARMACEUTICALS, INC. (US) 2008-03-20 — — WO disclosed
EP-0862560-B1 SUBSTITUTED 2-ANILINOPYRIMIDINES USEFUL AS PROTEIN KINASE INHIBITORS CELLTECH THERAPEUTICS LTD (GB) 2003-04-02 — — EP disclosed
US-6235746-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATIVE AGENT CELLTECH THERAPEUTICS, LIMITED (GB) 2001-05-22 — — US disclosed
US-5958935-A Substituted 2-anilinopyrimidines useful as protein kinase inhibitors CELLTECH THERAPEUTICS LIMITED (GB) 1999-09-28 — — 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-20080125417-A1 CERTAIN PYRIMIDINES, METHOD OF MAKING, AND METHOD OF USE THEREOF BTK, SYK, TK1 PRKCA 986/4885ZAP70 13/4885PRKD3 381/4885

“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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