SCHEMBL3496522

SCHEMBL3496522

CN1C(C)(C)CC(Nc2nc(Nc3cccc(C#N)c3)ncc2F)CC1(C)C

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.64
PRKCQ Q04759 1/20 0.53
EGFR P00533 5/20 0.52
BTK Q06187 3/20 0.52
CDC7 O00311 1/20 0.45
AURKA O14965 1/20 0.45
ITK Q08881 2/20 0.44
IGF1R P08069 1/20 0.43
MAOB P27338 1/20 0.43
GRM5 P41594 1/20 0.43
KDR P35968 1/20 0.43

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
SCHEMBL3494922 0.90 SYK (0.51) SYKPRKCQEGFRBTKCDC7
SCHEMBL3496111 0.88 SYK (0.58) SYKPRKCQEGFRBTKCDC7
SCHEMBL3497975 0.88 SYK (0.61) SYKPRKCQEGFRBTKAURKA
SCHEMBL3495077 0.88 SYK (0.65) SYKEGFRBTKCDC7AURKA
SCHEMBL3497992 0.86 PRKCQ (0.54) SYKPRKCQEGFRBTKAURKA
SCHEMBL3496000 0.86 PRKCQ (0.54) SYKPRKCQEGFRBTKAURKA
SCHEMBL3496950 0.85 KDR (0.61) SYKPRKCQEGFRBTKAURKA
SCHEMBL3494065 0.85 SYK (0.61) SYKPRKCQAURKA
SCHEMBL3495869 0.85 SYK (0.46) SYKPRKCQEGFRBTKAURKA
SCHEMBL3495467 0.85 SYK (0.57) 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 5 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
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.