SCHEMBL6040547

SCHEMBL6040547

COc1cc(OC)c(-c2cc3ccccc3s2)cc1C=CC(=O)c1ccc(S(=O)(=O)NC(=O)C(C)C)cc1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 13/20 0.67
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ABCG2 Q9UNQ0 1/20 0.43
ACLY P53396 2/20 0.40
MAOB P27338 1/20 0.39
DPP4 P27487 1/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1B1 Q16678 1/20 0.38

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
SCHEMBL6040544 1.00 TNFRSF1A (0.67) TNFRSF1AMEN1LMNAGAAMAPT
SCHEMBL6040921 0.86 TNFRSF1A (0.71) TNFRSF1AMAPTSMN1; SMN2ABCG2DPP4
SCHEMBL6040923 0.86 TNFRSF1A (0.71) TNFRSF1AMAPTSMN1; SMN2ABCG2DPP4
SCHEMBL6040561 0.85 TNFRSF1A (0.75) TNFRSF1AMEN1LMNAGAAMAPT
SCHEMBL6040565 0.85 TNFRSF1A (0.75) TNFRSF1AMEN1LMNAGAAMAPT
SCHEMBL5565351 0.84 MAPT (0.47) TNFRSF1AMEN1LMNAGAAMAPT
SCHEMBL5560103 0.84 MAPT (0.47) TNFRSF1AMEN1LMNAGAAMAPT
SCHEMBL5560107 0.84 MAPT (0.47) TNFRSF1AMEN1LMNAGAAMAPT
SCHEMBL6040522 0.83 TNFRSF1A (0.80) TNFRSF1AMEN1LMNAMAPTKMT2A
SCHEMBL6040517 0.83 TNFRSF1A (0.80) TNFRSF1AMEN1LMNAMAPTKMT2A

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-20060189549-A1 Chalcone derivatives and their use to treat diseases NI LIMING 2006-08-24 US disclosed
US-7094801-B2 Chalcone derivatives and their use to treat diseases ATHEROGENICS, INC. (US) 2006-08-22 US disclosed
EP-1465854-A4 CHALCONE DERIVATIVES AND THEIR USE TO TREAT DISEASES ATHEROGENICS INC (US) 2005-06-08 EP disclosed
EP-1465854-A2 CHALCONE DERIVATIVES AND THEIR USE TO TREAT DISEASES Atherogenics, Inc. (US) 2004-10-13 EP disclosed
US-20040048858-A1 Chalcone derivatives and their use to treat diseases CRABTREE ACQUISITION CO, LLC 2004-03-11 US disclosed
WO-2003053368-A2 CHALCONE DERIVATIVES AND THEIR USE TO TREAT DISEASES ATHEROGENICS, INC. (US) 2003-07-03 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-20060189549-A1 Chalcone derivatives and their use to treat diseases CYP46A1, HSD17B7, CYP11B2 TNFRSF1A 3846/4885MEN1 1759/4885LMNA 1624/4885
US-20040048858-A1 Chalcone derivatives and their use to treat diseases CYP46A1, CYP11B1, HSD17B7 TNFRSF1A 3877/4885MEN1 1050/4885LMNA 1834/4885

“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.