SCHEMBL3496385

SCHEMBL3496385

CC(C)N1C(=O)C(C)(C)Oc2cc(Nc3ncc(C#N)c(NC4CC(C)(C)N(C)C(C)(C)C4)n3)ccc21

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.37
SYK P43405 4/20 0.36
PKMYT1 Q99640 2/20 0.36
SLC9A1 P19634 1/20 0.36
PRKCQ Q04759 2/20 0.36
LRRK2 Q5S007 5/20 0.35
PTK2 Q05397 1/20 0.35
PTK2B Q14289 1/20 0.35
CSNK2A2 P19784 2/20 0.34
CSNK2A1 P68400 2/20 0.34
ULK1 O75385 1/20 0.34
PRKCD Q05655 1/20 0.34
AURKA O14965 1/20 0.34

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
SCHEMBL3495162 0.91 PTK2 (0.36) SLC2A1SYKPKMYT1SLC9A1PRKCQ
SCHEMBL3497196 0.88 PRKCQ (0.47) SYKSLC9A1PRKCQLRRK2PTK2
SCHEMBL3496014 0.88 LRRK2 (0.40) SLC2A1SYKPKMYT1PRKCQLRRK2
SCHEMBL3495251 0.87 PRKCQ (0.37) SLC2A1SYKPKMYT1PRKCQLRRK2
SCHEMBL3495540 0.85 PRKCQ (0.37) SLC2A1SYKPKMYT1PRKCQLRRK2
SCHEMBL3494607 0.80 SYK (0.36) SYKPRKCQLRRK2PTK2ULK1
SCHEMBL3496445 0.80 ULK1 (0.51) SYKPRKCQLRRK2ULK1
SCHEMBL3497097 0.79 PRKCQ (0.37) SLC2A1SYKPKMYT1PRKCQLRRK2
SCHEMBL3495604 0.79 SYK (0.36) SYKPRKCQLRRK2PTK2ULK1
SCHEMBL3496087 0.79 SYK (0.41) SLC2A1SYKPKMYT1PRKCQLRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 US claimed
EP-2183225-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2010-05-12 EP claimed
WO-2009012421-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2009-01-22 WO claimed
US-8993585-B2 Cyclic amine substituted pyrimidinediamines as PKC inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-03-31 US disclosed
US-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 US disclosed
EP-2183225-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2010-05-12 EP disclosed
WO-2009012421-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2009-01-22 WO 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-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS PRKCH, PKD2, PRKCQ SLC2A1 4131/4885SYK 460/4885PKMYT1 155/4885

“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.