SCHEMBL11932628

SCHEMBL11932628

Cc1cc(C)c(Nc2ccc(Nc3c(C)cc(C)c(S(=O)(=O)Cl)c3C)c3c2C(=O)c2ccccc2C3=O)c(C)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ HPGD P15428 3/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ MAPK1 P28482 3/20 0.43
▸ TDP1 Q9NUW8 3/20 0.43
▸ NSD2 O96028 2/20 0.43
▸ POLB P06746 2/20 0.43
▸ THRB P10828 2/20 0.43
▸ RECQL P46063 2/20 0.43
▸ P2RY1 P47900 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ P2RY4 P51582 7/20 0.38
▸ P2RY2 P41231 5/20 0.37
▸ MET P08581 3/20 0.37
▸ P2RY12 Q9H244 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35

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
SCHEMBL30887179 0.96 MEN1 (0.46) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL7740603 0.96 MEN1 (0.46) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL13316757 0.88 MAPT (0.48) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL8947711 0.84 MAPK1 (0.46) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL15894721 0.83 MAPT (0.56) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL29356228 0.82 P2RY1 (0.55) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL341554 0.82 P2RY1 (0.55) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL15452097 0.81 CXCR2 (0.46) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL15448839 0.80 SMN1; SMN2 (0.44) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL25851919 0.80 MAPK1 (0.53) MAPTMEN1KMT2ASMN1; SMN2HPGD

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
US-20120172529-A1 MIGRATION-FREE COLOURED COPOLYCONDENSATES FOR COLOURING POLYMERS BASF SE (DE) 2012-07-05 — — US disclosed
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