SCHEMBL8799741

SCHEMBL8799741

Cc1cc([N+](=O)[O-])cc(C)c1Oc1ccc(OCc2ccccc2)c(C(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
THRB P10828 5/20 0.43
THRA P10827 4/20 0.43
CYP19A1 P11511 6/20 0.42
RORC P51449 1/20 0.41
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
CTSV O60911 1/20 0.39
CTSL P07711 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
SCHEMBL6660357 0.85 MAPT (0.49) MEN1MAPTKMT2ACYP19A1CTSV
SCHEMBL5398175 0.84 THRB (0.43) MEN1MAPTKMT2ATHRBTHRA
SCHEMBL4965062 0.82 THRB (0.48) MEN1MAPTKMT2ATHRBTHRA
SCHEMBL6736474 0.81 MEN1 (0.46) MEN1MAPTKMT2ACYP19A1CYP11B1
SCHEMBL6738412 0.81 MEN1 (0.46) MEN1MAPTKMT2ACYP19A1CYP11B1
SCHEMBL6623929 0.81 MAPT (0.37) MEN1MAPTKMT2ATHRBTHRA
SCHEMBL27559091 0.81 MEN1 (0.45) MEN1MAPTKMT2ACYP19A1CYP11B1
SCHEMBL5391540 0.78 POLB (0.39) MEN1MAPTKMT2ATHRBTHRA
SCHEMBL5401768 0.78 THRB (0.44) MEN1MAPTKMT2ATHRBTHRA
SCHEMBL27559095 0.78 AR (0.50) MEN1MAPTKMT2ACYP19A1CTSV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0580550-B1 Oxamic acid derivatives as hypocholesteremic agents CIBA GEIGY AG (CH) 1997-10-22 EP disclosed
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
EP-0580550-A1 Oxamic acid derivatives as hypocholesteremic agents CIBA-GEIGY AG (CH) 1994-01-26 EP disclosed