SCHEMBL3496493

SCHEMBL3496493

CN1C(C)(C)CC(Nc2nc(Nc3ccc(OCC(N)=O)cc3)ncc2F)CC1(C)C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.62
PRKCQ Q04759 1/20 0.53
EGFR P00533 4/20 0.49
AURKA O14965 4/20 0.46
AURKB Q96GD4 4/20 0.46
KDR P35968 3/20 0.46
PLK4 O00444 2/20 0.46
PDPK1 O15530 2/20 0.46
DAPK3 O43293 2/20 0.46
JAK2 O60674 2/20 0.46
MAP4K4 O95819 2/20 0.46
PAK4 O96013 2/20 0.46
CHEK2 O96017 2/20 0.46
ERBB2 P04626 2/20 0.46
NTRK1 P04629 2/20 0.46
PRKCG P05129 2/20 0.46
INSR P06213 2/20 0.46
LCK P06239 2/20 0.46
FYN P06241 2/20 0.46
CDK1 P06493 2/20 0.46

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
SCHEMBL3495472 0.88 SYK (0.55) SYKPRKCQEGFRAURKAAURKB
SCHEMBL3496536 0.86 AURKA (0.58) SYKPRKCQEGFRAURKAAURKB
SCHEMBL3497350 0.83 AURKA (0.58) SYKPRKCQEGFRAURKAAURKB
SCHEMBL3495184 0.82 PRKCQ (0.57) SYKPRKCQEGFRAURKACDK2
SCHEMBL3494810 0.81 PRKCQ (0.50) SYKPRKCQEGFRAURKAAURKB
SCHEMBL3493781 0.81 PRKCQ (0.56) SYKPRKCQEGFRAURKAAURKB
SCHEMBL3493447 0.81 CDK2 (0.55) SYKPRKCQAURKAAURKBCDK1
SCHEMBL3495547 0.80 SYK (0.65) SYK
SCHEMBL3495530 0.80 PRKCQ (0.51) SYKPRKCQEGFRAURKAAURKB
SCHEMBL3497975 0.80 SYK (0.61) SYKPRKCQEGFRAURKAJAK2

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 SYK 460/4885PRKCQ 3/4885EGFR 1181/4885

“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.