SCHEMBL5565784

SCHEMBL5565784

C=C(C(=O)c1ccc(S(=O)(=O)Nc2cc(C)on2)cc1)c1cc(-c2cc3ccccc3n2C)c(OC)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C9 P11712 2/20 0.52
TSHR P16473 2/20 0.52
NPSR1 Q6W5P4 1/20 0.52
POLB P06746 1/20 0.43
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALOX12 P18054 2/20 0.41
MAPK1 P28482 1/20 0.41
EGFR P00533 1/20 0.41
KDR P35968 1/20 0.41
GAA P10253 2/20 0.41
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
ALDH1A1 P00352 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL5565826 0.99 HPGD (0.51) HPGDCYP1A2CYP2C9TSHRNPSR1
SCHEMBL5564216 0.86 HPGD (0.49) HPGDCYP1A2CYP2C9TSHRNPSR1
SCHEMBL5566290 0.85 KDM4E (0.35) HPGDPOLBKDRKMT2ALMNA
SCHEMBL5565582 0.85 PTGER3 (0.36) HPGDPOLBKDRGAAKMT2A
SCHEMBL5565781 0.85 ALDH1A1 (0.35) HPGDCYP1A2CYP2C9TSHRNPSR1
SCHEMBL5560041 0.83 KMT2A (0.49) HPGDCYP1A2CYP2C9TSHRNPSR1
SCHEMBL5565830 0.83 KMT2A (0.49) HPGDCYP1A2CYP2C9TSHRNPSR1
SCHEMBL5560043 0.83 KMT2A (0.49) HPGDCYP1A2CYP2C9TSHRNPSR1
SCHEMBL5565465 0.82 IMPDH2 (0.33) HPGDCYP1A2CYP2C9TSHRNPSR1
SCHEMBL6040934 0.82 CA2 (0.41) HPGDKMT2AALDH1A1

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 8 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
WO-2004108094-A2 SULFONAMIDE-SUBSTITUTED CHALCONE DERIVATIVES AND THEIR USE TO TREAT DISEASES ATHEROGENICS, INC. (US) 2004-12-16 WO 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
WO-2004108094-A2 SULFONAMIDE-SUBSTITUTED CHALCONE DERIVATIVES AND THEIR USE TO TREAT DISEASES ATHEROGENICS, INC. (US) 2004-12-16 WO 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 HPGD 845/4885CYP1A2 203/4885CYP2C9 262/4885
US-20070093453-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases STS, HPSE, SULT1E1 HPGD 845/4885CYP1A2 203/4885CYP2C9 262/4885

“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.