SCHEMBL6182902

SCHEMBL6182902

CCn1nnc2ccc(C(=O)O)cc21

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 14/20 0.78
PLA2G4A P47712 1/20 0.52
SLC9A1 P19634 1/20 0.51
HPGD P15428 1/20 0.49
HCAR2 Q8TDS4 1/20 0.49
MAPT P10636 2/20 0.48
KMO O15229 1/20 0.47
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL31130222 0.88 HCAR3 (0.60) HCAR3SLC9A1MAPTKMONPC1
SCHEMBL6044058 0.88 HCAR3 (1.00) HCAR3HPGDHCAR2MAPT
SCHEMBL6184141 0.84 HCAR3 (0.56) HCAR3SLC9A1MAPTMEN1NPC1
SCHEMBL14106775 0.81 HCAR3 (0.53) HCAR3PLA2G4ASLC9A1MAPTMEN1
SCHEMBL1256199 0.79 HCAR3 (0.76) HCAR3HPGDHCAR2MAPTMEN1
SCHEMBL31130343 0.78 HCAR3 (0.50) HCAR3SLC9A1MAPTNPC1RAB9A
SCHEMBL29022082 0.78 HCAR3 (0.80) HCAR3SLC9A1MAPTNPC1RAB9A
SCHEMBL2852713 0.77 HSD17B10 (0.56) HCAR3HPGDHCAR2
SCHEMBL6184550 0.76 HCAR3 (0.80) HCAR3HPGDHCAR2
SCHEMBL6044508 0.76 HCAR3 (1.00) HCAR3PLA2G4ASLC9A1HPGDHCAR2

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 HCAR3 495/4885PLA2G4A 3799/4885SLC9A1 1389/4885

“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.