SCHEMBL6184877

SCHEMBL6184877

Clc1cccc(-c2nc[nH]c2-c2ccc3nnn(-c4ccccc4)c3c2)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.60
MAPK14 Q16539 6/20 0.44
NT5E P21589 4/20 0.42
CYP3A4 P08684 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TGFBR1 P36897 2/20 0.37
TGFBR2 P37173 1/20 0.37

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
SCHEMBL6185556 0.88 IDO1 (0.44) IDO1MAPK14NT5ECYP3A4KDM4E
SCHEMBL6184920 0.86 TGFBR1 (0.46) IDO1MAPK14NT5ECYP3A4KDM4E
SCHEMBL6184801 0.84 MAPK14 (0.46) IDO1MAPK14NT5ECYP3A4KDM4E
SCHEMBL6185508 0.83 IDO1 (0.57) IDO1MAPK14CYP3A4KDM4EMAPT
SCHEMBL6186458 0.79 NT5E (0.43) MAPK14NT5ETGFBR1TGFBR2
SCHEMBL6186607 0.79 MAPK14 (0.48) MAPK14NT5ECYP3A4NPC1RAB9A
SCHEMBL6184681 0.77 NT5E (0.42) MAPK14NT5ETGFBR1TGFBR2
SCHEMBL6186115 0.77 NT5E (0.42) MAPK14NT5EMAPTTGFBR1TGFBR2
SCHEMBL6184025 0.76 IDO1 (0.40) IDO1MAPK14CYP3A4KDM4EMAPT
SCHEMBL18041606 0.76 IDO1 (0.62) IDO1MAPK14CYP3A4KDM4EMAPT

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 IDO1 231/4885MAPK14 27/4885NT5E 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.