SCHEMBL5859640

SCHEMBL5859640

CS(=O)(=O)N(Cc1ccc(-c2ccccn2)cc1)Cc1cccc(OCC(=O)O)c1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA12 O43570 15/20 0.67
CA1 P00915 15/20 0.67
CA2 P00918 15/20 0.67
CA4 P22748 15/20 0.67
CA9 Q16790 15/20 0.67
PTGER2 P43116 2/20 0.52
PTPN1 P18031 1/20 0.47

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
Hydrochloric Acid SCHEMBL5724718 0.99 CA12 (0.66) CA12CA1CA2CA4CA9
SCHEMBL5049391 0.89 CA12 (0.70) CA12CA1CA2CA4CA9
SCHEMBL5049385 0.88 CA12 (0.69) CA12CA1CA2CA4CA9
SCHEMBL4947759 0.84 CA12 (0.75) CA12CA1CA2CA4CA9
SCHEMBL5726684 0.84 CA12 (0.67) CA12CA1CA2CA4CA9
SCHEMBL6059327 0.84 CA12 (0.51) CA12CA1CA2CA4CA9
Hydrochloric Acid SCHEMBL6058754 0.84 CA12 (0.73) CA12CA1CA2CA4CA9
SCHEMBL5726193 0.83 CA12 (0.66) CA12CA1CA2CA4CA9
SCHEMBL5049386 0.81 PTGER2 (0.62) CA12CA1CA2CA4CA9
SCHEMBL5725362 0.80 CA12 (0.73) CA12CA1CA2CA4CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6998423-B2 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC. (US) 2006-02-14 US claimed