SCHEMBL7600217

SCHEMBL7600217

CS(=O)(=O)ONC(=O)OCc1ccccn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
LMNA P02545 2/20 0.58
MAPT P10636 1/20 0.50
CA2 P00918 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA9 Q16790 1/20 0.47
PARP10 Q53GL7 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PGR P06401 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
PTGS1 P23219 1/20 0.44
SLC6A2 P23975 1/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC2 Q92769 1/20 0.44

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
SCHEMBL7601766 0.86 LMNA (0.51) NPC1RAB9ASMN1; SMN2LMNACA2
SCHEMBL16078292 0.79 SMN1; SMN2 (0.68) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL13564630 0.79 NPC1 (0.68) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL6841168 0.77 NPC1 (0.64) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL15637509 0.75 NPC1 (0.62) NPC1RAB9ASMN1; SMN2LMNAMAPT
Carbamic Acid SCHEMBL7600209 0.75 PARP10 (0.51) NPC1RAB9ASMN1; SMN2LMNATDP1
SCHEMBL10290171 0.75 SMN1; SMN2 (0.62) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL22273449 0.74 SMN1; SMN2 (0.61) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL6223872 0.74 SMN1; SMN2 (0.59) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL31539875 0.74 LMNA (0.50) NPC1RAB9ASMN1; SMN2LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1266900-A1 Carbamates of rapamycin Wyeth (US) 2002-12-18 EP claimed
EP-0593227-A1 Carbamates of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1994-04-20 EP claimed
US-5302584-A Immunosuppressants AMERICAN HOME PRODUCTS CORPORATION (US) 1994-04-12 US claimed
EP-1266900-A1 Carbamates of rapamycin Wyeth (US) 2002-12-18 EP disclosed
US-5411967-A Antiinflammatory, immunosuppressant, antitumor AMERICAN HOME PRODUCTS CORPORATION (US) 1995-05-02 US disclosed
EP-0593227-A1 Carbamates of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1994-04-20 EP disclosed
US-5302584-A Immunosuppressants AMERICAN HOME PRODUCTS CORPORATION (US) 1994-04-12 US disclosed