SCHEMBL6469484

SCHEMBL6469484

COc1cc(-c2nc(-c3ccncc3)c(-c3ccccc3)[nH]2)ccc1O

nearest known ligand 0.88

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 2/20 0.88
SMPD3 Q9NY59 2/20 0.71
RAF1 P04049 9/20 0.67
MAPK13 O15264 9/20 0.67
MAPK12 P53778 9/20 0.67
MAPK11 Q15759 9/20 0.67
MAPK14 Q16539 9/20 0.67
BRAF P15056 4/20 0.64
TP53 P04637 3/20 0.64
MAPT P10636 3/20 0.64
THRB P10828 1/20 0.62
MAPK9 P45984 1/20 0.61
MPO P05164 1/20 0.60
BRDT Q58F21 1/20 0.58
GCGR P47871 2/20 0.57
ALOX5 P09917 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
SCHEMBL6466475 0.90 NOX1 (0.71) NOX1SMPD3RAF1MAPK13MAPK12
SCHEMBL6465030 0.89 MAPK13 (0.71) NOX1SMPD3RAF1MAPK13MAPK12
SCHEMBL6470345 0.85 NOX1 (0.65) NOX1SMPD3RAF1MAPK13MAPK12
SCHEMBL15075623 0.84 MAPK13 (0.71) NOX1SMPD3RAF1MAPK13MAPK12
SCHEMBL6465442 0.84 NOX1 (0.81) NOX1SMPD3RAF1MAPK13MAPK12
SCHEMBL8088592 0.84 NOX1 (0.81) NOX1SMPD3TP53MAPTTHRB
SCHEMBL6466417 0.83 NOX1 (0.79) NOX1SMPD3MAPK13MAPK12MAPK11
SCHEMBL18292680 0.82 NOX1 (0.78) NOX1SMPD3TP53MAPTTHRB
SCHEMBL27934209 0.82 MAPK13 (0.67) NOX1SMPD3RAF1MAPK13MAPK12
SCHEMBL7645951 0.81 MAPK13 (0.74) NOX1SMPD3RAF1MAPK13MAPK12

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 NOX1 2876/4885SMPD3 3746/4885RAF1 527/4885

“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.