SCHEMBL3997532

SCHEMBL3997532

COc1cc(Nc2nccc(-c3cccc(NC(=O)c4cccnc4)c3)n2)cc(OC)c1OC

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKCA P17252 8/20 0.71
▸ PRKCD Q05655 4/20 0.71
▸ PRKD3 O94806 2/20 0.71
▸ PRKCG P05129 2/20 0.71
▸ PRKCB P05771 2/20 0.71
▸ PRKCH P24723 2/20 0.71
▸ PRKCI P41743 2/20 0.71
▸ PRKCE Q02156 2/20 0.71
▸ PRKCQ Q04759 2/20 0.71
▸ PRKCZ Q05513 2/20 0.71
▸ PRKD1 Q15139 2/20 0.71
▸ LCK P06239 1/20 0.71
▸ ZAP70 P43403 1/20 0.71
▸ ABL1 P00519 17/20 0.71
▸ BCR P11274 17/20 0.71
▸ PDGFRB P09619 7/20 0.71
▸ PDGFRA P16234 7/20 0.71
▸ SRC P12931 4/20 0.71
▸ EGFR P00533 2/20 0.65
▸ ABL2 P42684 1/20 0.58

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
SCHEMBL4903186 0.89 ABL1 (0.75) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL4895700 0.86 ABL1 (0.75) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL6980016 0.86 PLK1 (0.69) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL4901012 0.85 PRKCA (0.74) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL6976605 0.84 ZAP70 (1.00) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL1522 0.83 ABL1 (1.00) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL4897378 0.82 ABL1 (0.64) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL4002022 0.82 PRKCA (0.58) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL4903101 0.81 ABL1 (0.59) PRKCAPRKCDPRKD3PRKCGPRKCB
SCHEMBL4900131 0.81 PDGFRA (0.77) PRKCAABL1BCRPDGFRBPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101605766-A Pyrimidine derivatives and they are as the purposes of kinase inhibitor CGI PHARMACEUTICALS INC (US) 2009-12-16 — — CN claimed
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
CN-101605766-A Pyrimidine derivatives and they are as the purposes of kinase inhibitor CGI PHARMACEUTICALS INC (US) 2009-12-16 — — CN disclosed
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 986/4885PRKCD 1111/4885PRKD3 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.

Send feedback