SCHEMBL3662852

SCHEMBL3662852

Cc1ccc(S(=O)(=O)N2CCN(CCc3ccc(Br)cc3)CC2)cc1

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.59
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
THRB P10828 1/20 0.57
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 1/20 0.55
STAT3 P40763 1/20 0.55
POLB P06746 1/20 0.54
PKM P14618 1/20 0.54
HTT P42858 1/20 0.54

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
SCHEMBL19392346 0.86 KMT2A (0.76) L3MBTL1KMT2AMEN1POLBPKM
SCHEMBL12310087 0.86 KDM4E (0.67) THRBALDH1A1KDM4ESTAT3PKM
SCHEMBL3974104 0.83 L3MBTL1 (0.75) L3MBTL1KMT2AMEN1ALDH1A1POLB
SCHEMBL13729458 0.80 MEN1 (0.51) KMT2AMEN1THRB
SCHEMBL16733908 0.80 ALDH1A1 (0.61) L3MBTL1KMT2AMEN1ALDH1A1POLB
SCHEMBL23646022 0.80 L3MBTL1 (0.71) L3MBTL1KMT2AMEN1ALDH1A1POLB
SCHEMBL10900411 0.80 CYP2C9 (0.69) KMT2AMEN1ALDH1A1POLBHTT
SCHEMBL7026165 0.79 KCNH2 (0.69) L3MBTL1KMT2AMEN1ALDH1A1KDM4E
SCHEMBL14924489 0.79 HRH3 (0.62) L3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL12169349 0.79 L3MBTL1 (0.69) L3MBTL1KMT2AMEN1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2235010-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS AstraZeneca AB (SE) 2010-10-06 EP disclosed
WO-2009081197-A1 BICYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF ANDROGEN RECEPTOR ASSOCIATED CONDITIONS ASTRAZENECA AB (SE) 2009-07-02 WO disclosed