SCHEMBL6178874

SCHEMBL6178874

CCc1nc(-c2ccccc2)cn1-c1ccc(CCNC(=O)NS(=O)(=O)c2ccc(C)cn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.46
CA2 P00918 7/20 0.39
CA1 P00915 6/20 0.39
CA9 Q16790 4/20 0.39
CA12 O43570 3/20 0.39
MAPT P10636 5/20 0.38
TP53 P04637 2/20 0.38
AGTR1 P30556 2/20 0.37
AGTR2 P50052 2/20 0.37
CA4 P22748 4/20 0.36
CA7 P43166 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.36
THRB P10828 1/20 0.36
LMNA P02545 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
SCHEMBL4446894 0.88 PTGER4 (0.58) PTGER4CA2CA1CA9CA12
SCHEMBL6332228 0.85 PTGER4 (0.55) PTGER4CA2CA1CA9CA12
SCHEMBL4454389 0.82 CA12 (0.54) PTGER4CA2CA1CA9CA12
SCHEMBL6175056 0.82 CA1 (0.43) PTGER4CA2CA1CA9CA12
SCHEMBL6179798 0.82 CA2 (0.52) PTGER4CA2CA1CA9CA12
SCHEMBL4450390 0.82 CA2 (0.52) PTGER4CA2CA1CA9CA12
SCHEMBL6176352 0.81 ALDH1A1 (0.44) MAPTTP53SMN1; SMN2ALDH1A1LMNA
SCHEMBL6329735 0.81 CA1 (0.51) PTGER4CA2CA1CA9CA12
SCHEMBL6337114 0.81 CA2 (0.51) PTGER4CA2CA1CA9CA12
SCHEMBL6175106 0.80 PTGER4 (0.47) PTGER4CA2CA1CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6956050-B2 Imidazole compounds as anti-inflammatory and analgesic agents PFIZER, INC. (US) 2005-10-18 US claimed
US-20030220372-A1 Imidazole compounds as anti-inflammatory and analgesic agents HIRANO MISATO (JP) 2003-11-27 US claimed
US-6956050-B2 Imidazole compounds as anti-inflammatory and analgesic agents PFIZER, INC. (US) 2005-10-18 US disclosed
EP-1494667-A1 IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS Pfizer Japan Inc. (JP) 2005-01-12 EP disclosed
US-20030220372-A1 Imidazole compounds as anti-inflammatory and analgesic agents HIRANO MISATO (JP) 2003-11-27 US disclosed
WO-2003086390-A1 IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER JAPAN INC. (JP) 2003-10-23 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-20030220372-A1 Imidazole compounds as anti-inflammatory and analgesic agents PTGS1, PTGS2, PTGES PTGER4 32/4885CA2 608/4885CA1 2155/4885

“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.