SCHEMBL8891500

SCHEMBL8891500

CC(C)c1cc(Oc2c(Cl)cc([N+](=O)[O-])cc2Cl)ccc1O

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRA P10827 12/20 0.65
THRB P10828 12/20 0.65

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
SCHEMBL5327992 0.89 THRB (0.52) THRATHRB
SCHEMBL4962573 0.86 THRB (0.59) THRATHRB
SCHEMBL2047915 0.85 THRA (0.65) THRATHRB
SCHEMBL5327698 0.84 RORC (0.62) THRATHRB
SCHEMBL14264310 0.82 THRA (0.58) THRATHRB
SCHEMBL7259163 0.81 KIF11 (0.47) THRATHRB
SCHEMBL25773015 0.81 THRB (0.71) THRATHRB
SCHEMBL22959316 0.80 NR1H4 (0.69) THRATHRB
SCHEMBL26982543 0.80 NR1H4 (0.50) THRATHRB
SCHEMBL5618384 0.79 THRA (1.00) THRATHRB

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