SCHEMBL6465019

SCHEMBL6465019

OCc1ccc(-c2nc(-c3ccncc3)c(-c3cccc(I)c3)[nH]2)cc1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRAF P15056 7/20 0.78
ALOX5 P09917 3/20 0.60
MAPK14 Q16539 12/20 0.59
MAPK13 O15264 11/20 0.59
MAPK12 P53778 11/20 0.59
MAPK11 Q15759 11/20 0.59
RAF1 P04049 5/20 0.59
MAPK9 P45984 1/20 0.58
BRDT Q58F21 1/20 0.55
GCGR P47871 6/20 0.54
CSNK1D P48730 1/20 0.54
CSNK1E P49674 1/20 0.54

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
SCHEMBL6469541 0.87 MAPK14 (0.76) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL6469294 0.84 MAPK13 (0.76) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL6467812 0.84 MAPK14 (0.76) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL6449352 0.82 MAPK13 (0.77) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL6467001 0.81 MAPK14 (0.72) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL4408322 0.81 BRAF (0.86) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL6468431 0.80 MAPK13 (0.73) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL6470570 0.80 MAPK14 (0.74) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL21068026 0.80 ALOX5 (0.58) BRAFALOX5MAPK14MAPK13MAPK12
SCHEMBL6468085 0.79 ALOX5 (0.69) BRAFALOX5MAPK14MAPK13MAPK12

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 BRAF 2300/4885ALOX5 4787/4885MAPK14 662/4885

“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.