SCHEMBL5565819

SCHEMBL5565819

C=C(C(=O)c1ccc(S(=O)(=O)N(C)C)cc1)c1cc(-c2cc3ccccc3n2C)c(OC)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 6/20 0.39
LMNA P02545 3/20 0.38
KDM4E B2RXH2 2/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
MAPT P10636 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.35
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TSHR P16473 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
SCHEMBL6040934 0.89 CA2 (0.41) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL5565582 0.88 PTGER3 (0.36) GAAALDH1A1LMNAKDM4EKMT2A
SCHEMBL5566290 0.88 KDM4E (0.35) ALDH1A1LMNAKDM4EKMT2AMEN1
SCHEMBL5565781 0.87 ALDH1A1 (0.35) GAAALDH1A1LMNAKDM4EKMT2A
SCHEMBL6040695 0.86 KMT2A (0.40) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL5564936 0.83 AKR1C3 (0.36) ALDH1A1LMNAKDM4E
SCHEMBL5565465 0.81 IMPDH2 (0.33) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL5565784 0.81 HPGD (0.52) GAAMAPK1ALDH1A1LMNAKMT2A
SCHEMBL5565826 0.80 HPGD (0.51) GAAMAPK1ALDH1A1LMNAKMT2A
SCHEMBL5565822 0.80 ABCG2 (0.46) GAAMAPK1ALDH1A1LMNAKMT2A

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-20070093453-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases ATHEROGENICS, INC. (US) 2007-04-26 US claimed
US-7173129-B2 Sulfonamide-substituted chalcone derivatives and their use to treat diseases ATHERO GENICS, INC. (US) 2007-02-06 US claimed
US-20050049236-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases CRABTREE ACQUISITION CO, LLC 2005-03-03 US claimed
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 GAA 269/4885MAPK1 2027/4885ALDH1A1 1653/4885
US-20070093453-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases STS, HPSE, SULT1E1 GAA 269/4885MAPK1 2027/4885ALDH1A1 1653/4885

“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.