SCHEMBL6269592

SCHEMBL6269592

Cc1c(C(=O)O)[nH]c2cc(Cl)c(Oc3ccc(O)c(S(=O)(=O)c4ccc(F)cc4)c3)c(Cl)c12

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 11/20 0.45
▸ THRA P10827 6/20 0.45
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ PTGS1 P23219 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ MCL1 Q07820 1/20 0.34
▸ GPR17 Q13304 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ POLB P06746 1/20 0.33

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
SCHEMBL6269595 0.88 THRB (0.42) THRBTHRAPTGS1PTGS2MCL1
SCHEMBL1642728 0.86 THRB (0.45) THRBTHRAMEN1KMT2AGAA
SCHEMBL1640591 0.81 THRB (0.60) THRBTHRAMEN1KMT2APTGS1
SCHEMBL6274795 0.78 THRB (0.45) THRBTHRAMEN1KMT2AGAA
SCHEMBL1642320 0.78 THRA (0.71) THRBTHRA
SCHEMBL6273741 0.74 THRB (0.42) THRBTHRAMEN1KMT2AGAA
SCHEMBL1640505 0.74 THRB (0.47) THRBTHRAMEN1KMT2AGAA
SCHEMBL4961949 0.74 POLB (0.43) THRBTHRAGAAGFERPOLB
SCHEMBL6854363 0.73 THRB (0.58) THRBTHRA
SCHEMBL6861848 0.73 THRB (0.42) THRBTHRAGAAPOLB

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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