SCHEMBL7304861

SCHEMBL7304861

CCCc1cc(OCC)c2c(c1OC)S(=O)(=O)N(CCl)C2=O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 12/20 0.37
HTT P42858 1/20 0.31
HMGCR P04035 1/20 0.31
MEN1 O00255 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
KMT2A Q03164 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL7304702 0.81 ELANE (0.44) ELANEHTTMEN1KMT2A
SCHEMBL7314724 0.74 ELANE (0.66) ELANE
SCHEMBL7309320 0.74 MAPT (0.44) ELANEHTTMEN1CYP3A4CYP2C9
SCHEMBL7288208 0.72 ELANE (0.39) ELANE
SCHEMBL7278649 0.72 ELANE (0.61) ELANE
SCHEMBL7313367 0.71 ELANE (0.42) ELANEHTTMEN1KMT2AALDH1A1
SCHEMBL7290646 0.71 ELANE (0.55) ELANEHTTMEN1KMT2AKDM4E
SCHEMBL7288144 0.69 ELANE (0.60) ELANE
SCHEMBL7288469 0.69 ELANE (0.49) ELANEHTTMEN1KMT2AKDM4E
SCHEMBL7291180 0.69 ELANE (0.51) ELANEKDM4E

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