SCHEMBL6447875

SCHEMBL6447875

C[S+]([O-])c1ccc(-c2nc(-c3ccccc3)c(-c3ccncc3)[nH]2)cc1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 15/20 0.72
MAPK12 P53778 15/20 0.72
MAPK11 Q15759 15/20 0.72
MAPK14 Q16539 15/20 0.72
RAF1 P04049 11/20 0.72
MAPK9 P45984 2/20 0.72
GCGR P47871 5/20 0.66
BRAF P15056 3/20 0.66
ALOX5 P09917 1/20 0.66
PRKD3 O94806 1/20 0.57
MAP4K4 O95819 1/20 0.57
FRK P42685 1/20 0.57
CSNK1A1 P48729 1/20 0.57
CSNK1D P48730 1/20 0.57
GSK3B P49841 1/20 0.57
PTK6 Q13882 1/20 0.57
PRKD2 Q9BZL6 1/20 0.57
CLK4 Q9HAZ1 1/20 0.57

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
Sb-203580 SCHEMBL146399 0.89 MAPK11 (0.75) MAPK13MAPK12MAPK11MAPK14RAF1
Sb-203580 SCHEMBL25800837 0.89 MAPK11 (0.75) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL9192799 0.89 MAPK11 (0.75) MAPK13MAPK12MAPK11MAPK14RAF1
Sb-203580 SCHEMBL220990 0.89 MAPK11 (0.75) MAPK13MAPK12MAPK11MAPK14RAF1
Sb-203580 SCHEMBL95208 0.89 MAPK11 (0.75) MAPK13MAPK12MAPK11MAPK14RAF1
Sb-203580 SCHEMBL27075368 0.89 MAPK11 (0.75) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL21068026 0.88 ALOX5 (0.58) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL6926311 0.88 TEK (0.65) MAPK13MAPK12MAPK11MAPK14RAF1
Sb-203580 SCHEMBL4890447 0.88 MAPK11 (0.73) MAPK13MAPK12MAPK11MAPK14RAF1
SCHEMBL15606600 0.87 MAPK14 (0.71) MAPK13MAPK12MAPK11MAPK14RAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050203155-A1 Imidazole compounds and human cellular proteins casein kinase I alpha, delta and epsilon as targets for medical intervention against Hepatitis C Virus infections AXXIMA PHARMACEUTICAL AG. (DE) 2005-09-15 US claimed
EP-1532118-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS Axxima Pharmaceuticals Aktiengesellschaft (DE) 2005-05-25 EP claimed
WO-2004005264-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS AXXIMA PHARMACEUTICALS AG (DE) 2004-01-15 WO claimed
US-20240000821-A1 CHEMICAL INHIBITORS AGAINST KINASES TO BLOCK TELOMERE ELONGATION IN CANCER UNIV JOHNS HOPKINS (US) 2024-01-04 US disclosed
US-20200078387-A1 CHEMICAL INHIBITORS AGAINST KINASES TO BLOCK TELOMERE ELONGATION IN CANCER THE JOHNS HOPKINS UNIVERSITY 2020-03-12 US disclosed
WO-2018112342-A1 CHEMICAL INHIBITORS AGAINST KINASES TO BLOCK TELOMERE ELONGATION IN CANCER THE JOHNS HOPKINS UNIVERSITY (US) 2018-06-21 WO disclosed
US-20050203155-A1 Imidazole compounds and human cellular proteins casein kinase I alpha, delta and epsilon as targets for medical intervention against Hepatitis C Virus infections AXXIMA PHARMACEUTICAL AG. (DE) 2005-09-15 US disclosed
EP-1532118-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS Axxima Pharmaceuticals Aktiengesellschaft (DE) 2005-05-25 EP disclosed
WO-2004005264-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF HEPATITIS C VIRUS INFECTIONS AXXIMA PHARMACEUTICALS AG (DE) 2004-01-15 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-20050203155-A1 Imidazole compounds and human cellular proteins casein kinase I alpha, delta and epsilon as targets for medical intervention against Hepatitis C Virus infections CSNK1G1, CSNK1E, CSNK1D MAPK13 456/4885MAPK12 732/4885MAPK11 1215/4885

“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.