SCHEMBL6201994

SCHEMBL6201994

c1ccc2c(c1)ncn2-c1ccno1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.53
POLB P06746 1/20 0.53
FGFR1 P11362 3/20 0.51
ROCK1 Q13464 1/20 0.46
MKNK1 Q9BUB5 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46
CYP17A1 P05093 1/20 0.43
PIK3CB P42338 1/20 0.43
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL8344942 0.78 HTT (0.60) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL29602591 0.74 HTT (0.55) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL30524297 0.72 HTT (0.62) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL2465676 0.72 MKNK2 (0.67) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL30402227 0.71 HTT (0.88) HTTPOLBFGFR1ALDH1A1
SCHEMBL3417306 0.71 HTT (0.73) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL3419279 0.71 HTT (0.88) HTTPOLBFGFR1ALDH1A1
Hydrochloric Acid SCHEMBL2491050 0.71 MKNK2 (0.65) HTTPOLBFGFR1ROCK1MKNK1
SCHEMBL9025863 0.70 PIK3CB (0.68) HTTPOLBFGFR1ROCK1MKNK1
Benzene SCHEMBL14876970 0.70 HTT (1.00) HTTFGFR1

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 HTT 375/4885POLB 3146/4885FGFR1 911/4885

“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.