SCHEMBL7278722

SCHEMBL7278722

CCOc1cc(O)cc2c1C(=O)NS2(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.35
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA9 Q16790 3/20 0.35
CA4 P22748 1/20 0.35
CA7 P43166 1/20 0.35
ESR2 Q92731 1/20 0.34
ELANE P08246 1/20 0.34
IGF1R P08069 3/20 0.33
RET P07949 1/20 0.33
GRK5 P34947 1/20 0.33
TYRO3 Q06418 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
CHEK1 O14757 1/20 0.32
WEE1 P30291 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
KDM4E B2RXH2 2/20 0.32

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
SCHEMBL7288175 0.84 ELANE (0.40) CA12CA1CA2CA9CA4
SCHEMBL11155859 0.74 CA12 (0.42) CA12CA1CA2CA9CA4
SCHEMBL7012037 0.74 ELANE (0.41) CA12CA1CA2CA9CA4
SCHEMBL7281545 0.70 ELANE (0.44) CA12CA1CA2CA9CA4
SCHEMBL7247959 0.70 ELANE (0.40) CA12CA1CA2CA9CA4
SCHEMBL7291180 0.70 ELANE (0.51) ESR2ELANEKDM4ENPC1MITF
SCHEMBL7290897 0.66 ALDH1A1 (0.46) CA12CA1CA2CA9CA4
SCHEMBL11681555 0.64 CA12 (0.53) CA12CA1CA2CA9CA4
SCHEMBL9541800 0.64 TSHR (0.57) ALDH1A1CYP3A4TSHRGAA
SCHEMBL28413851 0.62 TSHR (0.39) CA12CA1CA2CA9CA7

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
US-5597841-A 2-saccharinylmethyl aryl carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP, INC. (US) 1997-01-28 US disclosed
EP-0594257-B1 2-Saccharinylmethyl aryl carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP INC (US) 1996-07-10 EP disclosed
US-5512589-A TREATING DEGENERATIVE DISEASES STERLING WINTHROP INC. (US) 1996-04-30 US disclosed
EP-0594257-A1 2-Saccharinylmethyl aryl carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP INC. (US) 1994-04-27 EP disclosed
US-5306818-A Treating degenerative diseases such as emphysema, rheumatoid arthritis and pancreatitis STERLING WINTHROP INC. (US) 1994-04-26 US disclosed