SCHEMBL17002180

SCHEMBL17002180

COC(=O)c1ccc(-c2nc(-c3cccc(C)c3)c(-c3ccncc3)[nH]2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 1.00
CSNK1D P48730 7/20 0.78
CSNK1E P49674 7/20 0.78
RAF1 P04049 2/20 0.78
ALOX5 P09917 4/20 0.70
MAPK13 O15264 2/20 0.70
MAPK12 P53778 2/20 0.70
MAPK11 Q15759 2/20 0.70
GCGR P47871 1/20 0.70

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
SCHEMBL17002188 0.88 MAPK14 (1.00) MAPK14CSNK1DCSNK1ERAF1ALOX5
SCHEMBL18960500 0.88 MAPK14 (0.83) MAPK14CSNK1DCSNK1ERAF1ALOX5
SCHEMBL18960539 0.87 MAPK14 (0.77) MAPK14CSNK1DCSNK1ERAF1ALOX5
SCHEMBL17002187 0.87 MAPK14 (1.00) MAPK14CSNK1DCSNK1ERAF1ALOX5
SCHEMBL18960504 0.85 MAPK14 (0.78) MAPK14CSNK1DCSNK1ERAF1ALOX5
SCHEMBL18960503 0.84 MAPK14 (0.83) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL17002319 0.83 MAPK14 (1.00) MAPK14CSNK1DCSNK1ERAF1ALOX5
SCHEMBL17002185 0.83 MAPK14 (0.72) MAPK14CSNK1DCSNK1ERAF1MAPK13
SCHEMBL2649978 0.82 MAPK14 (1.00) MAPK14CSNK1DCSNK1ERAF1ALOX5
SCHEMBL4552086 0.81 RAF1 (0.88) MAPK14RAF1ALOX5MAPK13MAPK12

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
EP-3102207-B1 2,4,5-TRI-SUBSTITUTED AZOLE-BASED CASEIN KINASE 1 INHIBITORS AS INDUCERS FOR CARDIOMYOGENESIS AGENCY SCIENCE TECH & RES (SG) 2022-05-11 EP disclosed
US-10865384-B2 2,4,5-tri-substituted azole-based casein kinase 1 inhibitors as inducers for cardiomyogenesis AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-12-15 US disclosed
US-20170166867-A1 2,4,5-TRI-SUBSTITUTED AZOLE-BASED CASEIN KINASE 1 INHIBITORS AS INDUCERS FOR CARDIOMYOGENESIS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-06-15 US disclosed
US-20170166867-A1 2,4,5-TRI-SUBSTITUTED AZOLE-BASED CASEIN KINASE 1 INHIBITORS AS INDUCERS FOR CARDIOMYOGENESIS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-06-15 US disclosed
WO-2015119579-A1 2,4,5-TRI-SUBSTITUTED AZOLE-BASED CASEIN KINASE 1 INHIBITORS AS INDUCERS FOR CARDIOMYOGENESIS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-08-13 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 (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-10865384-B2 2,4,5-tri-substituted azole-based casein kinase 1 inhibitors as inducers for cardiomyogenesis CSNK1A1, CSNK1G1, CSNK2A1 MAPK14 241/4885CSNK1D 11/4885CSNK1E 6/4885
US-20170166867-A1 2,4,5-TRI-SUBSTITUTED AZOLE-BASED CASEIN KINASE 1 INHIBITORS AS INDUCERS FOR CARDIOMYOGENESIS CSNK1A1, CSNK1G1, CSNK2A1 MAPK14 241/4885CSNK1D 11/4885CSNK1E 6/4885

“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.