SCHEMBL9200976

SCHEMBL9200976

COc1ccc(CNCCNS(=O)(=O)c2ccc(Cl)c3ncccc23)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
HPGD P15428 4/20 0.56
KDM4E B2RXH2 4/20 0.56
HSD17B10 Q99714 1/20 0.56
LMNA P02545 1/20 0.52
POLB P06746 2/20 0.50
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
GAA P10253 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
USP2 O75604 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MAPT P10636 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42

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
SCHEMBL9194491 0.92 ALDH1A1 (0.55) ALDH1A1HPGDKDM4EHSD17B10LMNA
SCHEMBL9193433 0.89 ALDH1A1 (0.67) ALDH1A1HPGDKDM4EHSD17B10LMNA
SCHEMBL9199361 0.87 ALDH1A1 (0.62) ALDH1A1HPGDKDM4EHSD17B10LMNA
SCHEMBL9198656 0.83 KDM4E (0.47) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL9397144 0.82 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EHSD17B10LMNA
SCHEMBL9201315 0.81 ALDH1A1 (0.49) ALDH1A1HPGDKDM4EHSD17B10LMNA
SCHEMBL9200697 0.81 ALDH1A1 (0.56) ALDH1A1HPGDKDM4EHSD17B10LMNA
SCHEMBL9194304 0.80 LMNA (0.57) ALDH1A1HPGDKDM4EHSD17B10LMNA
SCHEMBL9198961 0.80 ALDH1A1 (0.63) ALDH1A1HPGDKDM4EHSD17B10LMNA
SCHEMBL9397200 0.80 ALDH1A1 (0.49) ALDH1A1HPGDKDM4EHSD17B10LMNA

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