SCHEMBL3495467

SCHEMBL3495467

CN1C(C)(C)CC(Nc2nc(Nc3cccc(C#N)c3)ncc2C(N)=O)CC1(C)C

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.57
ZAP70 P43403 1/20 0.55
JAK2 O60674 1/20 0.49
JAK3 P52333 1/20 0.49
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48

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
SCHEMBL3495855 0.88 BRD4 (0.45) SYKZAP70JAK2JAK3
SCHEMBL3494922 0.86 SYK (0.51) SYKJAK3
SCHEMBL3496522 0.85 SYK (0.64) SYK
SCHEMBL3495869 0.83 SYK (0.46) SYKJAK3
SCHEMBL3496111 0.79 SYK (0.58) SYKZAP70JAK3
SCHEMBL3495615 0.79 SYK (0.55) SYK
SCHEMBL3496405 0.79 SYK (0.51) SYK
SCHEMBL3494833 0.78 EPHB4 (0.47) SYK
SCHEMBL3494982 0.78 SYK (0.56) SYKJAK2
SCHEMBL3495176 0.77 SYK (0.70) SYK

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-20100130486-A1 CYCLIC AMINE SUBSTITUTED PYRIMIDINEDIAMINES AS PKC INHIBITORS RIGEL PHARMACEUTICALS, INC. 2010-05-27 US 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

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 SYK 460/4885ZAP70 186/4885JAK2 268/4885

“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.