SCHEMBL10290262

SCHEMBL10290262

CCc1ccc2c(n1)NC(=O)C(C)(C)O2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 5/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ BRD4 O60885 5/20 0.39
▸ KCNH2 Q12809 1/20 0.37
▸ BMPR1B O00238 1/20 0.36
▸ CDC7 O00311 1/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ PLK4 O00444 1/20 0.36
▸ STK25 O00506 1/20 0.36
▸ CIT O14578 1/20 0.36
▸ RIOK3 O14730 1/20 0.36
▸ CHEK1 O14757 1/20 0.36
▸ IKBKB O14920 1/20 0.36
▸ AURKA O14965 1/20 0.36
▸ GAK O14976 1/20 0.36
▸ CHUK O15111 1/20 0.36
▸ MUSK O15146 1/20 0.36
▸ EPHB6 O15197 1/20 0.36

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
SCHEMBL12235337 0.80 KCNH2 (0.32) KCNH2NPC1
SCHEMBL10239074 0.79 SYK (0.41) SYKKDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL12654383 0.78 SYK (0.41) SYKKDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL22096128 0.78 SYK (0.41) SYKKDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL22192 0.78 SYK (0.41) SYKKDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL24156807 0.78 SYK (0.41) SYKKDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL14235384 0.75 SYK (0.49) SYKKDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL5946341 0.75 SYK (0.39) SYKKDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL14361247 0.75 SYK (0.39) SYKKDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL10187826 0.75 SYK (0.39) SYKKDM4EALDH1A1SMN1; SMN2BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 — — US disclosed
US-20120253039-A1 Methods of Treating or Preventing Autoimmune Diseases with 2,4-Pyrimidinediamine Compounds RIGEL PHARMACEUTICALS, INC. (US) 2012-10-04 — — US disclosed
US-8178671-B2 Ring attached at N2 and N4 of 2,4-pyrimidinediamines; for treating rheumatoid arthritis; N4-(2,2-dimethyl-3-oxo-4H-5-pyrid[1,4]oxazin-6-yl)-5-fluoro-N2-(3,4,5-trimethoxyphenyl)-2,4-pyrimidinediamine RIGEL PHARMACEUTICALS, INC. (US) 2012-05-15 — — US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 — — US disclosed
US-7582648-B2 Methods of treating or preventing autoimmune diseases with 2,4-pyrimidinediamine compounds RIGEL PHARMACEUTICALS, INC. (US) 2009-09-01 — — US disclosed
US-20080312438-A1 METHODS OF TREATING OR PREVENTING AUTOIMMUNE DISEASES WITH 2,4-PYRIMIDINEDIAMINE COMPOUNDS RIGEL PHARMACEUTICALS, INC. (US) 2008-12-18 — — US disclosed
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 disclosed
US-20070167439-A1 METHODS OF TREATING OR PREVENTING AUTOIMMUNE DISEASES WITH 2,4-PYRIMIDINEDIAMINE COMPOUNDS RIGEL PHARMACEUTICALS, INC. (US) 2007-07-19 — — 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 (4 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-20120253039-A1 Methods of Treating or Preventing Autoimmune Diseases with 2,4-Pyrimidinediamine Compounds SSB, TPMT, ADAR SYK 2275/4885KDM4E 1602/4885ALDH1A1 2152/4885
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FYN, SYK, RET SYK 2/4885KDM4E 2223/4885ALDH1A1 2562/4885
US-20070167439-A1 METHODS OF TREATING OR PREVENTING AUTOIMMUNE DISEASES WITH 2,4-PYRIMIDINEDIAMINE COMPOUNDS SSB, TYMS, TPMT SYK 2199/4885KDM4E 2564/4885ALDH1A1 3877/4885
US-20080312438-A1 METHODS OF TREATING OR PREVENTING AUTOIMMUNE DISEASES WITH 2,4-PYRIMIDINEDIAMINE COMPOUNDS SSB, TYMS, TPMT SYK 2199/4885KDM4E 2564/4885ALDH1A1 3877/4885

“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.

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