SCHEMBL1377451

SCHEMBL1377451

NC(=O)c1cccc(O[C@H]2CCOC2)c1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 18/20 0.57
KCNH2 Q12809 15/20 0.54
OPRM1 P35372 10/20 0.54
OPRD1 P41143 5/20 0.51
PARP1 P09874 1/20 0.49

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
SCHEMBL30567549 1.00 OPRK1 (0.57) OPRK1KCNH2OPRM1OPRD1PARP1
SCHEMBL16618230 0.88 OPRK1 (0.59) OPRK1KCNH2OPRM1OPRD1PARP1
SCHEMBL6477823 0.87 EPHX2 (0.50) OPRK1
SCHEMBL29267960 0.87 EPHX2 (0.50) OPRK1
SCHEMBL30567543 0.87 EPHX2 (0.50) OPRK1
SCHEMBL30517690 0.87 EPHX2 (0.50) OPRK1
SCHEMBL28885485 0.87 POLB (0.45) OPRK1KCNH2OPRM1OPRD1
SCHEMBL6302570 0.82 PARP10 (0.64) OPRK1KCNH2PARP1
SCHEMBL17865584 0.81 OPRK1 (0.67) OPRK1KCNH2OPRM1OPRD1PARP1
SCHEMBL6487966 0.81 PDE4D (0.45)

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
JP-4651714-B2 2011-03-16 JP claimed
EP-1902052-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES AstraZeneca AB (SE) 2008-03-26 EP claimed
EP-1891058-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES AstraZeneca AB (SE) 2008-02-27 EP claimed
WO-2007007041-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES ASTRAZENECA AB (SE) 2007-01-18 WO claimed
WO-2006125972-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES ASTRAZENECA AB (SE) 2006-11-30 WO claimed
CN-116916914-A SOS1 inhibitors and uses thereof 锐新医药公司 2023-10-20 CN disclosed
EP-1902052-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES AstraZeneca AB (SE) 2008-03-26 EP disclosed
EP-1891058-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2007007041-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES ASTRAZENECA AB (SE) 2007-01-18 WO disclosed
WO-2006125972-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES ASTRAZENECA AB (SE) 2006-11-30 WO disclosed