SCHEMBL6960319

SCHEMBL6960319

CN(C)C1CCc2oc3ccc(NC(=O)OC(C)(C)C)cc3c2C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA9 Q16790 1/20 0.45
MAPT P10636 6/20 0.45
TP53 P04637 5/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
HTR1F P30939 1/20 0.42
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
LYN P07948 1/20 0.37
HCK P08631 1/20 0.37
SRC P12931 1/20 0.37
FRK P42685 1/20 0.37
BLK P51451 1/20 0.37
PTK6 Q13882 1/20 0.37
PSMB8 P28062 1/20 0.36
MAP4K4 O95819 1/20 0.36

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
SCHEMBL30909298 0.86 HTR1F (0.45) CA12CA1CA9MAPTTP53
SCHEMBL6962417 0.86 HTR1F (0.45) CA12CA1CA9MAPTTP53
SCHEMBL6956061 0.84 SMN1; SMN2 (0.48) MAPTTP53POLBGAAHTR1F
SCHEMBL30909221 0.83 HTR1F (0.43) MAPTTP53POLBGAAHTR1F
SCHEMBL6957421 0.82 SMN1; SMN2 (0.47) MAPTTP53POLBGAAHTR1F
SCHEMBL30908917 0.82 HTR1F (0.43) MAPTTP53POLBGAAHTR1F
SCHEMBL30909046 0.81 ALDH1A1 (0.47) MAPTTP53POLBGAAHTR1F
SCHEMBL30908849 0.81 HTR1F (0.53) CA9MAPTTP53POLBGAA
SCHEMBL6956818 0.81 HTR1F (0.53) CA9MAPTTP53POLBGAA
SCHEMBL6961514 0.81 ALDH1A1 (0.47) MAPTTP53POLBGAAHTR1F

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-0929299-B1 SUBSTITUTED 1,2,3,4-TETRAHYDRO-2-DIBENZOFURANAMINES AND 2-AMINOCYCLOHEPTA(b)BENZOFURANS LILLY CO ELI (US) 2003-10-08 EP disclosed
EP-0929299-A4 SUBSTITUTED 1,2,3,4-TETRAHYDRO-2-DIBENZOFURANAMINES AND 2-AMINOCYCLOHEPTA(b)BENZOFURANS LILLY CO ELI (US) 2000-12-20 EP disclosed
US-5935992-A TREATMENT OF MIGRAINE ELI LILLY AND COMPANY (US) 1999-08-10 US disclosed
US-5932739-A TREATMENT OF MIGRAINE ELI LILLY AND COMPANY (US) 1999-08-03 US disclosed
EP-0929299-A1 SUBSTITUTED 1,2,3,4-TETRAHYDRO-2-DIBENZOFURANAMINES AND 2-AMINOCYCLOHEPTA(b)BENZOFURANS ELI LILLY AND COMPANY (US) 1999-07-21 EP disclosed
US-5846995-A Substituted 1, 2, 3, 4-tetrahydro-2-dibenzofuranamines and 2-amino-cyclohepta (6, 7-B) Benzofurans ELI LILLY AND COMPANY (US) 1998-12-08 US disclosed
WO-1998008502-A1 SUBSTITUTED 1,2,3,4-TETRAHYDRO-2-DIBENZOFURANAMINES AND 2-AMINOCYCLOHEPTA[b]BENZOFURANS ELI LILLY AND COMPANY (US) 1998-03-05 WO disclosed