SCHEMBL2123139

SCHEMBL2123139

COc1ccc(-c2[nH]c3c(C#N)cnn3c2Nc2cccc(NC(C)=O)c2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.50
▸ ERBB2 P04626 1/20 0.50
▸ CSNK2A1 P68400 11/20 0.47
▸ DYRK1A Q13627 1/20 0.46
▸ DYRK1B Q9Y463 1/20 0.46
▸ CSNK2A2 P19784 1/20 0.45
▸ CSNK2B P67870 1/20 0.45
▸ FYN P06241 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ KIT P10721 1/20 0.43
▸ BRAF P15056 2/20 0.43
▸ POLB P06746 1/20 0.42

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
SCHEMBL2127338 0.92 EGFR (0.49) EGFRERBB2CSNK2A1CSNK2A2CSNK2B
SCHEMBL2127400 0.92 ALDH1A1 (0.47) EGFRERBB2CSNK2A1DYRK1ADYRK1B
SCHEMBL2126389 0.91 ALDH1A1 (0.47) EGFRERBB2CSNK2A1CSNK2A2CSNK2B
SCHEMBL2123440 0.89 CSNK2A1 (0.52) EGFRERBB2CSNK2A1CSNK2A2CSNK2B
SCHEMBL18686178 0.88 CSNK2A1 (0.44) EGFRERBB2CSNK2A1ALDH1A1
SCHEMBL2124067 0.88 MAPT (0.44) EGFRERBB2CSNK2A1ALDH1A1
SCHEMBL2122519 0.84 CSNK2A1 (0.48) EGFRERBB2CSNK2A1CSNK2A2CSNK2B
SCHEMBL2124785 0.84 BRAF (0.46) EGFRERBB2CSNK2A1FYNALDH1A1
SCHEMBL2125452 0.83 CSNK2A1 (0.47) EGFRERBB2CSNK2A1CSNK2A2CSNK2B
SCHEMBL2125777 0.82 CSNK2A1 (0.46) EGFRERBB2CSNK2A1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2443123-B1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS INC (US) 2017-04-05 — — EP claimed
US-8377945-B2 Small molecule inhibitors of spleen tyrosine kinase (SYK) RIGEL PHARMACEUTICALS INC. (US) 2013-02-19 — — US claimed
EP-2443123-A2 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) Rigel Pharmaceuticals, Inc. (US) 2012-04-25 — — EP claimed
WO-2010147898-A2 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS, INC. (US) 2010-12-23 — — WO claimed
US-20100316649-A1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) MIDCAP FINANCIAL TRUST 2010-12-16 — — US claimed
EP-2827890-B1 IMMUNOMODULATORY AGENT AND USES THEREFOR UNIV QUEENSLAND (AU) 2019-08-28 — — EP disclosed
EP-2443123-B1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS INC (US) 2017-04-05 — — EP disclosed
US-20150216955-A1 IMMUNOMODULATORY AGENT AND USES THEREFOR THE UNIVERSITY OF QUEENSLAND (AU) 2015-08-06 — — US disclosed
US-8377945-B2 Small molecule inhibitors of spleen tyrosine kinase (SYK) RIGEL PHARMACEUTICALS INC. (US) 2013-02-19 — — US disclosed
EP-2443123-A2 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) Rigel Pharmaceuticals, Inc. (US) 2012-04-25 — — EP disclosed
WO-2010147898-A2 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS, INC. (US) 2010-12-23 — — WO disclosed
US-20100316649-A1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) MIDCAP FINANCIAL TRUST 2010-12-16 — — 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 (2 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-20150216955-A1 IMMUNOMODULATORY AGENT AND USES THEREFOR HLA-DRB1, CD74, CHI3L1 EGFR 4464/4885ERBB2 4830/4885CSNK2A1 4410/4885
US-20100316649-A1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) SYK, BTK, LCK EGFR 1784/4885ERBB2 471/4885CSNK2A1 489/4885

“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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