SCHEMBL8892393

SCHEMBL8892393

CCOC(=O)CNc1cc(Cl)c(Oc2ccc(OC)c(Cc3ccc(F)cc3)c2)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
KCNH2 Q12809 1/20 0.40
THRB P10828 4/20 0.40
RORC P51449 2/20 0.40
THRA P10827 2/20 0.40
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARA Q07869 3/20 0.38
PPARD Q03181 2/20 0.38
PPARG P37231 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 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
SCHEMBL18932875 0.85 THRB (0.55) THRBRORCTHRAMAPT
SCHEMBL23863342 0.81 THRA (0.53) THRBTHRAMAPT
SCHEMBL18918559 0.81 THRB (0.48) THRBRORCTHRA
SCHEMBL282509 0.81 ATM (0.46) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL18932877 0.80 THRB (0.46) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL23863340 0.80 THRB (0.45) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL4960799 0.80 THRB (0.46) HTR2ASLC6A4KCNH2THRBRORC
SCHEMBL8892903 0.79 RORC (0.60) THRBRORCTHRA
SCHEMBL3221253 0.79 POLB (0.48) THRBTHRAPOLBMAPTALDH1A1
SCHEMBL282344 0.78 THRB (0.59) HTR2ASLC6A4KCNH2THRBRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5654468-A ANTILIPID, ANTICHOLESTEROL AGENTS CIBA-GEIGY CORPORATION (US) 1997-08-05 US disclosed
US-5569674-A ANTICHOLESTEROL AGENTS CIBA-GEIGY CORPORATION (US) 1996-10-29 US disclosed
US-5401772-A Anticholesterol agents with aromatic amines CIBA-GEIGY CORPORATION (US) 1995-03-28 US disclosed