SCHEMBL3495504

SCHEMBL3495504

CCOC(=O)N1CCC(Nc2nc(Nc3ccc(N4CCN(C)CC4)c(Cl)c3)ncc2F)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.56
SYK P43405 6/20 0.56
SIK1 P57059 2/20 0.54
SIK2 Q9H0K1 2/20 0.54
SIK3 Q9Y2K2 2/20 0.54
BCL6 P41182 1/20 0.53
BTK Q06187 3/20 0.52
JAK3 P52333 3/20 0.52
KDR P35968 2/20 0.52
FLT3 P36888 2/20 0.52
CSF1R P07333 2/20 0.52
TNK2 Q07912 2/20 0.52
CDC7 O00311 1/20 0.52
PLK4 O00444 1/20 0.52
CHEK1 O14757 1/20 0.52
AURKA O14965 1/20 0.52
DCLK1 O15075 1/20 0.52
PDPK1 O15530 1/20 0.52
DAPK3 O43293 1/20 0.52
JAK2 O60674 1/20 0.52

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
SCHEMBL3495111 0.93 EGFR (0.61) EGFRSYKSIK1SIK2SIK3
SCHEMBL3496601 0.90 ALK (0.52) EGFRSYKSIK1SIK2SIK3
SCHEMBL5105140 0.88 BRD4 (0.61) EGFRSYKSIK2SIK3BTK
SCHEMBL3494949 0.88 BCL6 (0.64) EGFRSYKSIK1SIK2SIK3
SCHEMBL3497333 0.87 EGFR (0.54) EGFRSYKSIK1SIK2SIK3
SCHEMBL3497282 0.86 SYK (0.54) EGFRSYKSIK1SIK2SIK3
SCHEMBL12952094 0.85 SYK (0.59) EGFRSYKSIK1SIK2SIK3
SCHEMBL3497092 0.85 BCL6 (0.54) EGFRSYKSIK1SIK2SIK3
Hydrochloric Acid SCHEMBL27662179 0.84 SYK (0.61) EGFRSYKSIK1SIK2SIK3
Hydrochloric Acid SCHEMBL27662239 0.83 SYK (0.58) EGFRSYKSIK1SIK2SIK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7452879-B2 N4-(1-tert-Butoxycarbonylazetidin-3-yl)-5-fluoro-N2-(4-morpholinophenyl)-2,4-pyrimidinediamine; signal transduction cascade inhibitor; Fc receptors for IgE (\"Fc epsilon RI\") and IgG (\"Fc gamma RI\") antagonist; autoimmune diseases, antiinflammatory agent; rheumatoid arthritis, multiple sclerosis RIGEL PHARMACEUTICALS, INC. (US) 2008-11-18 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
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 EGFR 1181/4885SYK 460/4885SIK1 882/4885

“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.