SCHEMBL2233640

SCHEMBL2233640

CCC(ON=Cc1cc(Br)c(Oc2ccc(OC)c(-c3ccccc3)c2)c(Br)c1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
MAPT P10636 2/20 0.40
PPARG P37231 4/20 0.38
PPARA Q07869 4/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
PKM P14618 1/20 0.37
POLB P06746 3/20 0.36
MMP1 P03956 2/20 0.36
CTSA P10619 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
APP P05067 1/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TNFRSF1A P19438 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.34

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
SCHEMBL2233635 1.00 LMNA (0.40) LMNAMAPTPPARGPPARAALDH1A1
SCHEMBL2183907 0.92 MAPT (0.41) LMNAMAPTPPARGALDH1A1HPGD
SCHEMBL16496323 0.92 MAPT (0.41) LMNAMAPTPPARGALDH1A1HPGD
SCHEMBL16496437 0.89 THRA (0.43) THRATHRB
SCHEMBL2169676 0.89 THRA (0.43) THRATHRB
SCHEMBL2827035 0.88 TNFRSF1A (0.38) LMNAMAPTALDH1A1HPGDPKM
SCHEMBL2827033 0.88 TNFRSF1A (0.38) LMNAMAPTALDH1A1HPGDPKM
SCHEMBL16496686 0.86 MAPT (0.42) LMNAMAPTPPARGALDH1A1HPGD
SCHEMBL2169903 0.86 MAPT (0.42) LMNAMAPTPPARGALDH1A1HPGD
SCHEMBL16495869 0.82 LMNA (0.42) LMNAMAPTPPARGALDH1A1HPGD

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-2346814-A2 THYROID RECEPTOR LIGANDS Cadila Healthcare Limited (IN) 2011-07-27 EP claimed