SCHEMBL28764074

SCHEMBL28764074

C=C(C#N)S(=O)(=O)c1ccccc1.c1cc2cc-2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.41
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
PKM P14618 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 2/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
ALPG P10696 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KAT6A Q92794 3/20 0.40
CA2 P00918 3/20 0.37
CA9 Q16790 2/20 0.37
KMO O15229 1/20 0.37
CA12 O43570 1/20 0.37

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
SCHEMBL742011 0.89 PKM (0.46) HPGDALDH1A1KMT2ASMN1; SMN2PKM
SCHEMBL28938490 0.77 KMT2A (0.44) HPGDALDH1A1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL5695964 0.73 MEN1 (0.34) KMT2AMEN1KAT6A
SCHEMBL5695962 0.72 MEN1 (0.38) HPGDKMT2APKMMEN1CA2
SCHEMBL11152641 0.72 HPGD (0.47) HPGDALDH1A1KMT2ASMN1; SMN2PKM
SCHEMBL11879645 0.72 TSHR (0.47) ALDH1A1KMT2ASMN1; SMN2PKMMEN1
SCHEMBL12220338 0.69 TDP1 (0.53) HPGDALDH1A1KMT2ASMN1; SMN2PKM
SCHEMBL10599045 0.69 SMN1; SMN2 (0.55) ALDH1A1KMT2ASMN1; SMN2L3MBTL1HSD17B10
SCHEMBL27640914 0.69 PKM (0.47) HPGDALDH1A1KMT2ASMN1; SMN2PKM
SCHEMBL9276097 0.68 KIF11 (0.43) KMT2AMEN1CA2CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101649203-B Stabilization of organic materials CIBA SC HOLDING AG 2013-12-18 CN disclosed
CN-101023128-B Stabilization of organic materials CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2012-02-22 CN disclosed
CN-101649203-A Stabilization of organic materials CIBA SC HOLDING AG CH 2010-02-17 CN disclosed
CN-101023128-A Stabilization of organic materials CIBA SC HOLDING AG (CH) 2007-08-22 CN disclosed