SCHEMBL1742406

SCHEMBL1742406

CN1C(C)(C)CC(Nc2nc(Nc3ccc(OC4CCOC4)c(OC(F)F)c3)ncc2F)CC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 10/20 0.48
ITK Q08881 4/20 0.48
PRKCQ Q04759 1/20 0.47
TBK1 Q9UHD2 1/20 0.41
GPR6 P46095 2/20 0.39
BCL6 P41182 2/20 0.39
ULK1 O75385 1/20 0.38
ULK2 Q8IYT8 1/20 0.38
BMX P51813 1/20 0.37
BTK Q06187 1/20 0.37
CSNK2A2 P19784 2/20 0.37
CSNK2A1 P68400 2/20 0.37

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
SCHEMBL1742405 1.00 EGFR (0.48) EGFRITKPRKCQTBK1GPR6
SCHEMBL3504671 0.95 PRKCQ (0.48) EGFRITKPRKCQTBK1GPR6
SCHEMBL1740806 0.90 EGFR (0.49) EGFRITKPRKCQTBK1GPR6
SCHEMBL1740804 0.90 EGFR (0.49) EGFRITKPRKCQTBK1GPR6
SCHEMBL3496207 0.89 PRKCQ (0.55) EGFRITKPRKCQTBK1BCL6
SCHEMBL1742238 0.88 PRKCQ (0.48) EGFRPRKCQBCL6ULK1ULK2
SCHEMBL1739734 0.86 PRKCQ (0.51) EGFRITKPRKCQBCL6ULK1
SCHEMBL1741121 0.86 PRKCQ (0.57) EGFRITKPRKCQBCL6ULK1
SCHEMBL3502624 0.86 PRKCQ (0.47) EGFRITKPRKCQBCL6ULK1
SCHEMBL1741022 0.86 PRKCQ (0.47) EGFRITKPRKCQGPR6BCL6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130210810-A1 Protein Kinase C Inhibitors and Uses Thereof RIGEL PHARMACEUTICALS, INC. (US) 2013-08-15 US claimed
US-20100204208-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2010-08-12 US claimed
EP-2389373-B1 DERIVATIVES OF N2-(3-PYRIDYL OR PHENYL)-N4-(4-PIPERIDYL)-2,4-PYRIMIDINEDIAMINE USEFUL IN THE TREATMENT OF INFLAMMATORY, AUTOIMMUNE OR PROLIFERATIVE DISEASES RIGEL PHARMACEUTICALS INC (US) 2017-05-17 EP disclosed
US-9149475-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2015-10-06 US disclosed
US-20130210810-A1 Protein Kinase C Inhibitors and Uses Thereof RIGEL PHARMACEUTICALS, INC. (US) 2013-08-15 US disclosed
US-8377924-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS INC. (US) 2013-02-19 US disclosed
EP-2389373-A1 DERIVATIVES OF N2-(3-PYRIDIL OR PHENYL)-N4-(4-PIPERIDYL)-2,4-PYRIMIDINEDIAMINE USEFUL IN THE TREATMENT OF INFLAMMATORY, AUTOIMMUNE OR PROLIFERATIVE DISEASES Rigel Pharmaceuticals, Inc. (US) 2011-11-30 EP disclosed
US-20110253835-A1 AIRCRAFT INTERIOR LAVATORY BE INTELLECTUAL PROPERTY, INC. (US) 2011-10-20 US disclosed
WO-2010090875-A1 DERIVATIVES OF N2-(3-PYRIDIL OR PHENYL)-N4-(4-PIPERIDYL)-2,4-PYRIMIDINEDIAMINE USEFUL IN THE TREATMENT OF INFLAMMATORY, AUTOIMMUNE OR PROLIFERATIVE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2010-08-12 WO disclosed
US-20100204208-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF MIDCAP FINANCIAL TRUST 2010-08-12 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-20100204208-A1 PROTEIN KINASE C INHIBITORS AND USES THEREOF PRKCH, PRKCA, PRKCB EGFR 2299/4885ITK 884/4885PRKCQ 5/4885
US-20130210810-A1 Protein Kinase C Inhibitors and Uses Thereof PRKCH, PRKCA, PRKCB EGFR 2299/4885ITK 884/4885PRKCQ 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.