SCHEMBL6188438

SCHEMBL6188438

COC(=O)c1nc(-c2cccc(C)c2)c(-c2ccc3nnn(-c4ccccc4)c3c2)[nH]1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.45
GAA P10253 1/20 0.42
NT5E P21589 2/20 0.39
TP53 P04637 2/20 0.39
CSNK1D P48730 2/20 0.39
CSNK1E P49674 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
DHODH Q02127 1/20 0.37
ALOX12 P18054 1/20 0.36
MAPT P10636 1/20 0.36
PDE10A Q9Y233 1/20 0.36
RAF1 P04049 1/20 0.36

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
SCHEMBL6185563 0.91 MAPK14 (0.43) MAPK14GAANT5ECSNK1DCSNK1E
SCHEMBL6184293 0.90 NT5E (0.41) MAPK14NT5ETP53MEN1KMT2A
SCHEMBL6182069 0.90 NT5E (0.41) MAPK14NT5ETP53CSNK1DCSNK1E
SCHEMBL6183056 0.89 MAPK14 (0.43) MAPK14NT5ECSNK1DCSNK1EPDE10A
SCHEMBL6183189 0.83 MAPK14 (0.40) MAPK14GAANT5ETP53CSNK1D
SCHEMBL6186115 0.80 NT5E (0.42) MAPK14GAANT5ETP53MAPT
SCHEMBL6184613 0.80 KCNMA1 (0.43) MAPK14NT5EMEN1KMT2A
SCHEMBL6186458 0.80 NT5E (0.43) MAPK14GAANT5ERAF1
SCHEMBL6184681 0.78 NT5E (0.42) MAPK14GAANT5ERAF1
SCHEMBL6182974 0.77 MAPK14 (0.41) MAPK14CSNK1DCSNK1EPDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1247810-B1 Novel benzotriazoles anti-inflammatory compounds PFIZER PROD INC (US) 2005-09-07 EP disclosed
US-6664395-B2 Benzotriazole compoundsn are the potent inhibitors of MAP kinases, preferably p38 kinase. They are useful for treating inflammation, osteoarthritis, rheumatoid arthritis, cancer, reperfusion, ischemia PFIZER INC 2003-12-16 US disclosed
US-20030078432-A1 Novel benzotriazoles anti-inflammatory compounds PFIZER INC. 2003-04-24 US disclosed
EP-1247810-A1 Novel benzotriazoles anti-inflammatory compounds Pfizer Products Inc. (US) 2002-10-09 EP 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-20030078432-A1 Novel benzotriazoles anti-inflammatory compounds MAPK1, JAK1, RUNX1 MAPK14 27/4885GAA 4762/4885NT5E 4156/4885

“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.