SCHEMBL9198535

SCHEMBL9198535

CCOc1ccc(S(=O)(=O)NCCNCc2ccc3c(c2)OCO3)c2cccnc12

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.68
LMNA P02545 5/20 0.68
KMT2A Q03164 4/20 0.68
MEN1 O00255 2/20 0.68
L3MBTL1 Q9Y468 2/20 0.68
GLA P06280 1/20 0.68
HSP90AA1 P07900 1/20 0.68
HSP90AB1 P08238 1/20 0.68
PKM P14618 1/20 0.68
ALDH1A1 P00352 9/20 0.58
HPGD P15428 5/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58
CYP2C19 P33261 1/20 0.58
TSHR P16473 2/20 0.55
HSD17B10 Q99714 1/20 0.49
POLB P06746 2/20 0.49
MAPT P10636 1/20 0.49

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
SCHEMBL9192720 0.92 KDM4E (0.67) KDM4ELMNAKMT2AMEN1L3MBTL1
SCHEMBL9194304 0.86 LMNA (0.57) KDM4ELMNAKMT2AMEN1L3MBTL1
SCHEMBL9193433 0.85 ALDH1A1 (0.67) KDM4ELMNAKMT2AMEN1L3MBTL1
SCHEMBL9397291 0.84 LMNA (0.65) KDM4ELMNAKMT2AMEN1L3MBTL1
SCHEMBL9397296 0.83 ALDH1A1 (0.69) KDM4ELMNAKMT2AMEN1L3MBTL1
SCHEMBL9398318 0.82 LMNA (0.62) KDM4ELMNAKMT2AMEN1L3MBTL1
SCHEMBL9200540 0.82 ALDH1A1 (0.67) KDM4ELMNAKMT2AMEN1L3MBTL1
SCHEMBL9195860 0.82 ALDH1A1 (0.83) KDM4ELMNAKMT2AMEN1L3MBTL1
SCHEMBL9196105 0.81 LMNA (0.60) KDM4ELMNAL3MBTL1ALDH1A1HPGD
SCHEMBL9195293 0.78 LMNA (0.52) KDM4ELMNAKMT2AMEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0471841-B1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME ASAHI CHEMICAL IND (JP) 1995-11-02 EP disclosed
US-5340811-A Bronchodilator agent ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1994-08-23 US disclosed
EP-0471841-A1 SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1992-02-26 EP disclosed