SCHEMBL7301329

SCHEMBL7301329

ClCCCSc1nnnn1-c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.66
TSHR P16473 5/20 0.66
L3MBTL1 Q9Y468 4/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
NPC1 O15118 2/20 0.66
NFKB1 P19838 2/20 0.66
RAB9A P51151 2/20 0.66
NFKB2 Q00653 2/20 0.66
RELA Q04206 2/20 0.66
TDP1 Q9NUW8 1/20 0.66
LMNA P02545 6/20 0.66
HPGD P15428 4/20 0.66
TP53 P04637 3/20 0.62
POLB P06746 3/20 0.61
NPSR1 Q6W5P4 1/20 0.61
MAPK1 P28482 1/20 0.59
MAPT P10636 3/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
GAA P10253 1/20 0.58

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
SCHEMBL10970208 0.91 ALDH1A1 (0.71) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL10973042 0.91 ALDH1A1 (0.71) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL1978183 0.85 ALDH1A1 (0.62) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL17761121 0.85 ALDH1A1 (0.68) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL24305911 0.85 ALDH1A1 (0.68) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL7303919 0.85 ALDH1A1 (0.66) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL10972734 0.85 ALDH1A1 (0.63) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL16116944 0.85 ALDH1A1 (0.72) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL3698359 0.84 ALDH1A1 (0.87) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1
SCHEMBL9137875 0.84 ALDH1A1 (0.71) ALDH1A1TSHRL3MBTL1SMN1; SMN2NPC1

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 10 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
EP-0471756-B1 SACCHARIN DERIVATIVES USEFUL AS PROTEOLYTIC ENZYME INHIBITORS AND PREPARATION THEREOF SANOFI SA (FR) 1997-10-29 EP 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
EP-0471756-A4 SACCHARIN DERIVATIVES USEFUL AS PROTEOLYTIC ENZYME INHIBITORS AND PREPARATION THEREOF 1992-04-08 EP disclosed
EP-0471756-A1 SACCHARIN DERIVATIVES USEFUL AS PROTEOLYTIC ENZYME INHIBITORS AND PREPARATION THEREOF. STERLING WINTHROP INC (US) 1992-02-26 EP disclosed
WO-1990013549-A1 SACCHARIN DERIVATIVES USEFUL AS PROTEOLYTIC ENZYME INHIBITORS AND PREPARATION THEREOF STERLING WINTHROP INC. (US) 1990-11-15 WO disclosed