SCHEMBL6861254

SCHEMBL6861254

Cc1cc(NC(C)C(=O)O)cc(C)c1Oc1ccc(O)c(S(=O)(=O)c2ccc(F)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRA P10827 7/20 0.45
THRB P10828 7/20 0.45
L3MBTL1 Q9Y468 1/20 0.41
CNR1 P21554 1/20 0.41
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL1640506 0.86 THRA (0.48) THRATHRBL3MBTL1CNR1ALDH1A1
SCHEMBL1642407 0.85 THRA (0.58) THRATHRB
SCHEMBL6738408 0.83 THRA (0.51) THRATHRBCNR1
SCHEMBL6854726 0.83 THRB (0.43) THRATHRBL3MBTL1CNR1ALDH1A1
SCHEMBL1642319 0.83 THRA (0.59) THRATHRB
SCHEMBL6738420 0.83 THRA (0.44) THRATHRBL3MBTL1ALDH1A1GAA
SCHEMBL1642411 0.83 THRA (0.49) THRATHRBL3MBTL1CNR1ALDH1A1
SCHEMBL7063019 0.83 THRA (0.55) THRATHRBCNR1
SCHEMBL6742192 0.82 THRA (0.52) THRATHRBGAA
SCHEMBL7061490 0.82 THRA (0.56) THRATHRBCNR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6790978-B2 4-HYDROXY-3-ARYLSULFONYL, 3-AMINOSULFONYL OR 3-AMINOCARBONYL-PHENOXYANILINOCARBONYL-OPTIONAL ALKYLENE-CARBOXYLIC ACID OR CARBONYL-5-TETRAZOLES NOVARTIS AG (CH) 2004-09-14 US disclosed
US-20020045751-A1 Thyromimetic organic compounds NOVARTIS AG (CH) 2002-04-18 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 (1 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-20020045751-A1 Thyromimetic organic compounds TPO, THRA, LPO THRA 2/4885THRB 7/4885L3MBTL1 154/4885

“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.