SCHEMBL6271002

SCHEMBL6271002

Cc1cc2[nH]c(OC(=O)O)cc2c(C)c1Oc1ccc(O)c(S(=O)(=O)NC2CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 12/20 0.41
▸ BRD4 O60885 5/20 0.37
▸ BRD2 P25440 2/20 0.37
▸ BRD3 Q15059 2/20 0.37
▸ THRA P10827 6/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL6268718 0.97 THRB (0.46) THRBBRD4BRD2BRD3THRA
SCHEMBL1640702 0.88 THRB (0.47) THRBBRD4BRD2BRD3THRA
SCHEMBL6794754 0.84 THRB (0.46) THRBBRD4BRD2BRD3THRA
SCHEMBL6273242 0.84 THRB (0.49) THRBBRD4BRD2BRD3THRA
SCHEMBL1642115 0.84 THRB (0.47) THRBBRD4BRD2BRD3THRA
SCHEMBL6795305 0.83 THRB (0.47) THRBBRD4BRD2BRD3THRA
SCHEMBL6268739 0.83 THRB (0.54) THRBTHRA
SCHEMBL6273498 0.83 THRB (0.52) THRBTHRA
SCHEMBL6273618 0.82 THRB (0.51) THRBTHRA
SCHEMBL6275290 0.80 PTGS1 (0.40) THRBTHRASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1297833-B1 Indole carboxylic acids as thyroid receptor ligands PFIZER PROD INC (US) 2005-12-21 — — EP claimed
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