SCHEMBL7360746

SCHEMBL7360746

C=C1C(C)=C(C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C[C@@H]2S1(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
MAPT P10636 1/20 0.34
ELANE P08246 2/20 0.34
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31
RIPK1 Q13546 1/20 0.31
NR1I2 O75469 1/20 0.31
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL7360743 1.00 KMT2A (0.36) KMT2AESR1ESR2MAPTELANE
SCHEMBL8667176 0.80 ESR1 (0.34) ESR1ESR2ELANEALDH1A1KDM4E
SCHEMBL9460459 0.80 ELANE (0.43) ESR1ESR2ELANEALDH1A1KDM4E
SCHEMBL8668726 0.80 ELANE (0.43) ESR1ESR2ELANEALDH1A1KDM4E
SCHEMBL8667178 0.80 ESR1 (0.34) ESR1ESR2ELANEALDH1A1KDM4E
SCHEMBL9635856 0.77 ELANE (0.45) KMT2AESR1ESR2MAPTELANE
SCHEMBL8668638 0.73 KMT2A (0.36) KMT2AESR1ESR2ELANEALDH1A1
SCHEMBL11075343 0.71 KMT2A (0.34) KMT2AESR1ESR2MAPTELANE
SCHEMBL11083750 0.70 ALDH1A1 (0.43) KMT2AESR1ESR2MAPTELANE
SCHEMBL11083737 0.70 ALDH1A1 (0.43) KMT2AESR1ESR2MAPTELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733055-A1 2-SPIRO(2'-SPIROCYCLOALKYL)CYCLOPROPYL CEPHALOSPORIN SULFONES AS ANTIINFLAMMATORY AND ANTIDEGENERATIVE AGENTS SYNPHAR LABORATORIES INC. (CA) 1996-09-25 EP disclosed
US-5439904-A Enzyme inhibitors of human leukocyte elastase; respiratory system disorders; antiarthritic agents SYNPHAR LABORATORIES, INC. (CA) 1995-08-08 US disclosed
WO-1995015966-A1 2-SPIRO(2'-SPIROCYCLOALKYL)CYCLOPROPYL CEPHALOSPORIN SULFONES AS ANTIINFLAMMATORY AND ANTIDEGENERATIVE AGENTS SYNPHAR LABORATORIES, INC. (CA) 1995-06-15 WO disclosed
US-5264430-A Enzyme inhibitor, antiinflammatory agents, treats emphysema, cystic fibrosis and arthritis SYNPHAR LABORATORIES, INC. (CA) 1993-11-23 US disclosed
US-5264429-A Enzyme inhibitor, antiinflammatory agents, treats emphysema, cystic fibrosis and arthritis SYNPHAR LABORATORIES, INC. (CA) 1993-11-23 US disclosed