SCHEMBL6272516

SCHEMBL6272516

Cc1cc2[nH]c(OC(=O)O)cc2c(C)c1Oc1ccc(O)c(C(=O)N(C)C2CCC2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 7/20 0.36
▸ THRA P10827 5/20 0.36
▸ PDE3B Q13370 6/20 0.35
▸ PDE3A Q14432 6/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ PDE5A O76074 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ PTAFR P25105 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ PDE1A P54750 1/20 0.33
▸ PDE1B Q01064 1/20 0.33
▸ PMP22 Q01453 1/20 0.33
▸ PDE1C Q14123 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
SCHEMBL1642351 0.88 THRB (0.47) THRBTHRAPDE3BPDE3AMEN1
SCHEMBL6273257 0.83 PDE3B (0.37) THRBTHRAPDE3BPDE3AMEN1
SCHEMBL6268718 0.78 THRB (0.46) THRBTHRAALDH1A1
SCHEMBL6268739 0.78 THRB (0.54) THRBTHRA
SCHEMBL6274873 0.78 THRA (0.45) THRBTHRAMEN1KMT2AKDM4E
SCHEMBL6270966 0.78 THRA (0.41) THRBTHRA
SCHEMBL6275008 0.77 THRA (0.59) THRBTHRA
SCHEMBL6275027 0.76 THRB (0.39) THRBTHRAMEN1KMT2AHPGD
SCHEMBL6272078 0.76 THRA (0.42) THRBTHRA
SCHEMBL6273498 0.76 THRB (0.52) THRBTHRA

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
Send feedback