SCHEMBL5565284

SCHEMBL5565284

C=C(C(=O)c1ccc(S(N)(=O)=O)cc1)c1cc(C#Cc2ccccc2N)c(OC)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 13/20 0.41
CA2 P00918 13/20 0.41
CA9 Q16790 12/20 0.41
CA12 O43570 8/20 0.41
CA7 P43166 4/20 0.41
CA14 Q9ULX7 4/20 0.41
PTGS2 P35354 2/20 0.38
PTGS1 P23219 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 1/20 0.37
PTGES O14684 1/20 0.36
TSHR P16473 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL5564806 0.84 KMT2A (0.46) CA1CA2KDM4EMAPTTSHR
SCHEMBL5559874 0.78 CYP19A1 (0.51) ALDH1A1POLB
SCHEMBL5565292 0.77 ABCG2 (0.51) CA1CA2MAPTALDH1A1
SCHEMBL5565287 0.77 ABCG2 (0.51) CA1CA2MAPTALDH1A1
SCHEMBL5564572 0.72 GAA (0.47) CA1CA2CA9CA12CA7
SCHEMBL6040694 0.72 CA2 (0.52) CA1CA2CA9CA12POLB
SCHEMBL6040555 0.72 TNFRSF1A (0.50) CA1CA2CA9CA12CA7
SCHEMBL5565638 0.72 CA2 (0.47) CA1CA2CA9CA12CA7
SCHEMBL6040934 0.71 CA2 (0.41) CA1CA2CA9CA12CA7
SCHEMBL6040556 0.69 CA2 (0.39) CA1CA2CA9CA12CA7

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-20070093453-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases ATHEROGENICS, INC. (US) 2007-04-26 US disclosed
US-7173129-B2 Sulfonamide-substituted chalcone derivatives and their use to treat diseases ATHERO GENICS, INC. (US) 2007-02-06 US disclosed
US-20050049236-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases CRABTREE ACQUISITION CO, LLC 2005-03-03 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-20050049236-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases STS, HPSE, SULT1E1 CA1 3675/4885CA2 899/4885CA9 1619/4885
US-20070093453-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases STS, HPSE, SULT1E1 CA1 3675/4885CA2 899/4885CA9 1619/4885

“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.