SCHEMBL15112593

SCHEMBL15112593

O=C(O)Cc1cc(Cl)c(OCC2CC2)c(Br)c1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 19/20 0.76
THRA P10827 17/20 0.76
PPARG P37231 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL4887024 0.93 THRB (0.86) THRBTHRAPPARG
SCHEMBL4897968 0.86 THRB (1.00) THRBTHRAPPARG
SCHEMBL3655263 0.84 THRB (0.54) THRBTHRAMEN1KMT2A
SCHEMBL3661614 0.77 THRB (0.56) THRBTHRA
SCHEMBL10940612 0.75 KMO (0.53) THRBTHRAPPARG
SCHEMBL3680135 0.74 THRA (0.65) THRBTHRAMEN1KMT2A
SCHEMBL15111384 0.74 APP (0.46) THRBTHRAMEN1KMT2A
SCHEMBL15112620 0.74 APP (0.50) THRBTHRAMEN1KMT2A
SCHEMBL4896502 0.73 THRB (1.00) THRBTHRA
SCHEMBL8033396 0.72 APP (0.63) THRBTHRAMEN1KMT2A

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
WO-2013106328-A1 TETRASUBSTITUTED BENZENES FOR TREATMENT OF EARLY ONSET ALZHEIMER'S DISEASE ENVIVO PHARMACEUTICALS, INC. (US) 2013-07-18 WO disclosed