SCHEMBL7305233

SCHEMBL7305233

CCOc1ccc(OCC(=O)OC(C)(C)C)c2c1C(=O)N(CCl)S2(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.38
HPGD P15428 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 1/20 0.35
TSHR P16473 1/20 0.35
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
ACLY P53396 1/20 0.33
POLB P06746 2/20 0.32
TNFRSF1A P19438 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
IGF1R P08069 1/20 0.31
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL7312138 0.88 ELANE (0.38) ELANEHPGDALDH1A1KMT2AHSD17B10
SCHEMBL7304160 0.84 ELANE (0.41) ELANEHPGDALDH1A1KMT2AKDM4E
SCHEMBL7312086 0.77 ELANE (0.65) ELANEALDH1A1POLB
SCHEMBL7287654 0.75 ELANE (0.36) ELANEALDH1A1KDM4EL3MBTL1
SCHEMBL8872494 0.72 ELANE (0.42) ELANEALDH1A1POLBNPSR1
SCHEMBL7288469 0.70 ELANE (0.49) ELANEHPGDALDH1A1KMT2AKDM4E
SCHEMBL7383593 0.68 ELANE (0.63) ELANE
SCHEMBL7305007 0.65 MAPT (0.43) ELANEALDH1A1KMT2AKDM4EMEN1
SCHEMBL7278099 0.65 ELANE (0.39) ELANEHPGDALDH1A1KMT2AKDM4E
SCHEMBL7306464 0.65 MAPT (0.40) ELANEHPGDALDH1A1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5874432-A Saccharin derivatives useful as proteolytic enzyme inhibitors and compositions and method of use thereof SANOFI (FR) 1999-02-23 US disclosed
US-5650422-A TREATMENT OF EMPHYSEMA, ARTHRITIS OR PANCREATITIS SANOFI (FR) 1997-07-22 US disclosed
US-5596012-A Saccharin derivatives useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP INC. (US) 1997-01-21 US disclosed
US-5371074-A Use of saccharin derivatives as proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1994-12-06 US disclosed
US-5236917-A Respiratory system disorders, antiarthritic agents STERLING WINTHROP INC. (US) 1993-08-17 US disclosed
EP-0542372-A1 2-Substituted saccharin derivative proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1993-05-19 EP disclosed