SCHEMBL5559618

SCHEMBL5559618

COc1cc(OCC(CO[Si](C)(C)C(C)(C)C)C(O[SiH](C)C)C(C)(C)C)c(C=O)cc1-c1cccs1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 2/20 0.35
ERN1 O75460 2/20 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
SCHEMBL5559611 0.84 ERN1 (0.40) TNFRSF1AERN1
SCHEMBL6040634 0.81 ERN1 (0.40) TNFRSF1AERN1
SCHEMBL6040854 0.78 TNFRSF1A (0.35) TNFRSF1AERN1
SCHEMBL6040641 0.74 TNFRSF1A (0.35) TNFRSF1AERN1
SCHEMBL5565722 0.72 ERN1 (0.47) TNFRSF1AERN1
SCHEMBL5560733 0.71 TNFRSF1A (0.57) TNFRSF1AERN1
SCHEMBL6040583 0.69 ERN1 (0.47) TNFRSF1AERN1
SCHEMBL5605276 0.68
SCHEMBL5559926 0.68 ERN1 (0.49) TNFRSF1AERN1
SCHEMBL6040679 0.68 TNFRSF1A (0.52) TNFRSF1AERN1

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 4 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
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 TNFRSF1A 3941/4885ERN1 2156/4885
US-20070093453-A1 Sulfonamide-substituted chalcone derivatives and their use to treat diseases STS, HPSE, SULT1E1 TNFRSF1A 3941/4885ERN1 2156/4885

“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.