SCHEMBL1889690

SCHEMBL1889690

CCCc1nc2c(NS(=O)(=O)Cc3ccc(F)cc3)cccc2n1CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.42
▸ BRD4 O60885 2/20 0.41
▸ PTGDR2 Q9Y5Y4 1/20 0.41
▸ GLO1 Q04760 1/20 0.40
▸ AGTR1 P30556 3/20 0.38
▸ AGTR2 P50052 3/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ APEX1 P27695 1/20 0.37
▸ F2 P00734 1/20 0.37
▸ PRSS1 P07477 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
SCHEMBL1893562 0.78 PPARG (0.42) PPARGPTGDR2AGTR1AGTR2APEX1
SCHEMBL1889687 0.74 PTGDR2 (0.39) PPARGPTGDR2APEX1
SCHEMBL1885452 0.73 TRPM8 (0.41) PPARGPTGDR2KMT2A
SCHEMBL1890982 0.71 APEX1 (0.49) PPARGPTGDR2AGTR1AGTR2APEX1
SCHEMBL1886847 0.70 BRD4 (0.38) BRD4KMT2A
SCHEMBL1888097 0.68 PPARG (0.38) PPARGAGTR1AGTR2
SCHEMBL1889207 0.68 SMN1; SMN2 (0.42) PPARGPTGDR2KMT2A
SCHEMBL1887901 0.68 PPARG (0.39) PPARGPTGDR2APEX1
SCHEMBL1892270 0.67 LMNA (0.55) PTGDR2F2
SCHEMBL8026444 0.67 GLO1 (0.46) BRD4GLO1AGTR1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110105573-A1 BENZIMIDAZOLE ACETIC ACIDS EXHIBITING CRTH2 RECEPTOR ANTAGONISM AND USES THEREOF WYETH 2011-05-05 — — US disclosed
US-7732618-B2 Benzimidazole acetic acids exhibiting CRTH2 receptor antagonism and uses thereof WYETH (US) 2010-06-08 — — US disclosed
US-20060106081-A1 Benzimidazole acetic acids exhibiting CRTH2 receptor antagonism and uses thereof WYETH 2006-05-18 — — US 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 (2 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-20060106081-A1 Benzimidazole acetic acids exhibiting CRTH2 receptor antagonism and uses thereof HRH2, TBXA2R, PTGDR2 PPARG 123/4885BRD4 954/4885PTGDR2 3/4885
US-20110105573-A1 BENZIMIDAZOLE ACETIC ACIDS EXHIBITING CRTH2 RECEPTOR ANTAGONISM AND USES THEREOF HRH2, TBXA2R, PTGDR2 PPARG 123/4885BRD4 954/4885PTGDR2 3/4885

“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.

Send feedback