SCHEMBL5565287

SCHEMBL5565287

COc1cc(OC)c(/C=C/C(=O)c2ccc(S(N)(=O)=O)cc2)cc1C#Cc1ccccc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.51
▸ CA1 P00915 2/20 0.49
▸ CA2 P00918 2/20 0.49
▸ PTPN1 P18031 7/20 0.49
▸ MAPT P10636 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ DPP4 P27487 4/20 0.46
▸ MAOB P27338 1/20 0.45
▸ SNCA P37840 1/20 0.45
▸ CTSL P07711 1/20 0.44
▸ CTSB P07858 1/20 0.44
▸ CYP1A1 P04798 1/20 0.44
▸ CYP1B1 Q16678 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL5565292 1.00 ABCG2 (0.51) ABCG2CA1CA2PTPN1MAPT
SCHEMBL5560023 0.86 MAPT (0.48) ABCG2PTPN1MAPTSMN1; SMN2MEN1
SCHEMBL5560030 0.86 MAPT (0.48) ABCG2PTPN1MAPTSMN1; SMN2MEN1
SCHEMBL5564809 0.84 MEN1 (0.51) ABCG2MAPTSMN1; SMN2MEN1LMNA
SCHEMBL5564810 0.84 MEN1 (0.51) ABCG2MAPTSMN1; SMN2MEN1LMNA
SCHEMBL5559876 0.78 CYP19A1 (0.50) MAPTSMN1; SMN2MEN1LMNAGAA
SCHEMBL5559878 0.78 CYP19A1 (0.50) MAPTSMN1; SMN2MEN1LMNAGAA
SCHEMBL5565284 0.77 CA1 (0.41) CA1CA2MAPTALDH1A1
SCHEMBL5565649 0.73 TNFRSF1A (0.50) ABCG2CA1CA2PTPN1MAPT
SCHEMBL5565645 0.73 TNFRSF1A (0.50) ABCG2CA1CA2PTPN1MAPT

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 ABCG2 7/4885CA1 3675/4885CA2 899/4885
US-20070093453-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases STS, HPSE, SULT1E1 ABCG2 7/4885CA1 3675/4885CA2 899/4885

“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.

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