SCHEMBL3396435

SCHEMBL3396435

Cc1nc(Nc2ncc(C(N)=O)s2)cc(N2CCN(CCO)CC2)n1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 14/20 0.73
SIK2 Q9H0K1 12/20 0.73
SIK3 Q9Y2K2 12/20 0.73
SIK1 P57059 10/20 0.73
SRC P12931 6/20 0.71
PKMYT1 Q99640 3/20 0.69
KIT P10721 4/20 0.67
BCR P11274 3/20 0.67
EPHB6 O15197 2/20 0.67
EGFR P00533 2/20 0.67
LCK P06239 2/20 0.67
FYN P06241 2/20 0.67
CSF1R P07333 2/20 0.67
YES1 P07947 2/20 0.67
LYN P07948 2/20 0.67
RET P07949 2/20 0.67
HCK P08631 2/20 0.67
BRAF P15056 2/20 0.67
EPHA1 P21709 2/20 0.67
EPHA2 P29317 2/20 0.67

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
SCHEMBL29885048 1.00 ABL1 (0.73) ABL1SIK2SIK3SIK1SRC
Water SCHEMBL3226546 0.99 ABL1 (0.72) ABL1SIK2SIK3SIK1SRC
SCHEMBL3536666 0.91 ABL1 (0.75) ABL1SIK2SIK3SIK1SRC
SCHEMBL30144989 0.91 ABL1 (0.75) ABL1SIK2SIK3SIK1SRC
SCHEMBL14141736 0.90 ABL1 (0.73) ABL1SIK2SIK3SIK1SRC
SCHEMBL12438117 0.90 ABL1 (0.73) ABL1SIK2SIK3SIK1SRC
SCHEMBL18971581 0.90 ABL1 (0.72) ABL1SIK2SIK3SIK1SRC
SCHEMBL31688158 0.89 SIK2 (0.66) ABL1SIK2SIK3SIK1SRC
SCHEMBL14141969 0.88 ABL1 (0.70) ABL1SIK2SIK3SIK1SRC
SCHEMBL14142047 0.86 SIK2 (0.68) ABL1SIK2SIK3SIK1SRC

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
WO-2021074620-A1 [1,4]OXAZEPINO[2,3-C]QUI NOLI NONE DERIVATIVES AS BLC6 INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2021-04-22 WO disclosed
WO-2021032129-A1 KINASE INHIBITOR, PREPARATION THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF 湖南华纳大药厂股份有限公司 2021-02-25 WO disclosed
US-20180055887-A1 METHOD FOR PREPARING INDUCED MESENCHYMAL STEM CELLS AND IMPROVING MESENCHYMAL STEM CELL'S CHARACTERS AND ITS APPLICATIONS ACADEMIA SINICA (TW) 2018-03-01 US disclosed
CN-104292223-A Novel synthetic method of dasatinib CHANGZHOU RUIBO BIO TECHNOLOGY CO LTD 2015-01-21 CN disclosed
CN-101948467-B Thiazoleamide compound and use thereof for the preparation of anti-malignant tumor medicines SUZHOU BORUI PHARMACEUTICAL INC 2012-07-25 CN disclosed
CN-101973989-B Thiazole amide compound and medicinal application thereof for treating malignancy SUZHOU BORUI PARMACEUTICALS INC 2012-07-18 CN disclosed
CN-101967142-B Thiazoleamide compound and medical application thereof in treating malignant tumor SUZHOU BORUI BIOPHARMACEUTICAL TECHNOLOGY CO LTD 2012-05-30 CN disclosed
WO-2010011605-A2 CONTROLLED-RELEASE OTIC STRUCTURE MODULATING AND INNATE IMMUNE SYSTEM MODULATING COMPOSITIONS AND METHODS FOR THE TREATMENT OF OTIC DISORDERS OTONOMY, INC. (US) 2010-01-28 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-20180055887-A1 METHOD FOR PREPARING INDUCED MESENCHYMAL STEM CELLS AND IMPROVING MESENCHYMAL STEM CELL'S CHARACTERS AND ITS APPLICATIONS NES, MYADM, CXCL12 ABL1 3959/4885SIK2 1791/4885SIK3 2033/4885

“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.