SCHEMBL2563753

SCHEMBL2563753

CN1CCN(c2cccc(Nc3ncc(F)c(Nc4ccc5c(n4)NC(=O)C(C)(C)O5)n3)c2)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.63
CDK2 P24941 4/20 0.62
JAK2 O60674 3/20 0.62
JAK1 P23458 3/20 0.62
CDK1 P06493 3/20 0.62
CDK7 P50613 3/20 0.62
EGFR P00533 3/20 0.62
FLT3 P36888 3/20 0.62
BTK Q06187 3/20 0.62
ADORA3 P0DMS8 2/20 0.62
TYRO3 Q06418 2/20 0.62
NTRK1 P04629 2/20 0.62
NTRK3 Q16288 2/20 0.62
NTRK2 Q16620 2/20 0.62
JAK3 P52333 2/20 0.62
BMPR1B O00238 1/20 0.62
CDC7 O00311 1/20 0.62
PIK3CD O00329 1/20 0.62
PLK4 O00444 1/20 0.62
STK25 O00506 1/20 0.62

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
SCHEMBL2566715 0.91 SYK (0.64) SYKCDK2JAK2JAK1CDK1
SCHEMBL2524410 0.91 SYK (0.63) SYKCDK2JAK2JAK1CDK1
SCHEMBL2570110 0.90 SYK (0.64) SYKCDK2JAK2JAK1CDK1
SCHEMBL2565258 0.88 SYK (0.64) SYKCDK2JAK2JAK1CDK1
SCHEMBL14481819 0.87 CTSC (0.53) SYKCDK2JAK2JAK1CDK1
SCHEMBL13268031 0.87 CTSC (0.53) SYKCDK2JAK2JAK1CDK1
SCHEMBL2564348 0.87 SYK (0.64) SYKCDK2JAK2JAK1CDK1
Hydrochloric Acid SCHEMBL15388424 0.86 SYK (0.63) SYKCDK2JAK2JAK1CDK1
SCHEMBL2525313 0.86 SYK (0.61) SYKCDK2JAK2JAK1CDK1
SCHEMBL3234146 0.84 SYK (0.59) SYKCDK2JAK2JAK1CDK1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8518937-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2013-08-27 US claimed
US-20130012501-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. 2013-01-10 US claimed
US-8278299-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2012-10-02 US claimed
EP-2382210-A2 PYRIMIDINEDIAMINE KINASE INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2011-11-02 EP claimed
US-20100179134-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2010-07-15 US claimed
WO-2010078369-A2 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2010-07-08 WO claimed
US-9040527-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-05-26 US disclosed
US-9040527-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-05-26 US disclosed
US-9040527-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2015-05-26 US disclosed
US-20130309228-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2013-11-21 US disclosed
US-20130309228-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2013-11-21 US disclosed
US-8518937-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2013-08-27 US disclosed
US-8518937-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2013-08-27 US disclosed
US-20130012501-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. 2013-01-10 US disclosed
US-20130012501-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. 2013-01-10 US disclosed
US-8278299-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2012-10-02 US disclosed
US-8278299-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2012-10-02 US disclosed
US-8278299-B2 Pyrimidinediamine kinase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2012-10-02 US disclosed
US-20100179134-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2010-07-15 US disclosed
US-20100179134-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2010-07-15 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 (3 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-20130012501-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS PLK1, TK1, DTYMK SYK 2106/4885CDK2 19/4885JAK2 854/4885
US-20100179134-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS PLK1, TK1, DTYMK SYK 2304/4885CDK2 18/4885JAK2 994/4885
US-20130309228-A1 PYRIMIDINEDIAMINE KINASE INHIBITORS PLK1, TK1, DTYMK SYK 2106/4885CDK2 19/4885JAK2 854/4885

“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.