SCHEMBL9835965

SCHEMBL9835965

CCn1ncc2c(Cl)c(C(=O)c3ccccc3)cnc21

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 14/20 0.60
PDE4B Q07343 6/20 0.54
PGR P06401 1/20 0.53
PDE5A O76074 1/20 0.45

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
SCHEMBL9835287 0.90 NR3C1 (0.67) NR3C1PDE4BPGR
SCHEMBL9834161 0.89 PDE4B (0.60) NR3C1PDE4BPGRPDE5A
SCHEMBL9833982 0.88 NR3C1 (0.57) NR3C1PDE4BPGRPDE5A
SCHEMBL9836172 0.88 NR3C1 (0.55) NR3C1PDE4BPGRPDE5A
SCHEMBL9835196 0.87 NR3C1 (0.67) NR3C1PDE4BPGRPDE5A
SCHEMBL9833383 0.86 NR3C1 (0.55) NR3C1PDE4BPGRPDE5A
SCHEMBL9835355 0.86 PDE4B (0.55) NR3C1PDE4BPGRPDE5A
SCHEMBL9834976 0.85 NR3C1 (0.67) NR3C1PDE4BPGRPDE5A
SCHEMBL9834731 0.85 NR3C1 (0.55) NR3C1PDE4BPGR
SCHEMBL9833323 0.84 NR3C1 (0.53) NR3C1PDE4BPGRPDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230016-B1 6H-Isoxazolo[3,4-d]pyrazolo[3,4-b]pyridines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-09-11 EP disclosed
EP-0230622-A1 6H-Isoxazol[5,4-d]pyrazolo[3,4-b]pyridines, a process and intermediates for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1987-08-05 EP disclosed
EP-0230016-A1 6H-Isoxazolo[3,4-d]pyrazolo[3,4-b]pyridines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1987-07-29 EP disclosed
US-4658029-A ANALGESICS, HYPOTENSIVE AGENTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1987-04-14 US disclosed
US-4624955-A 6H-isoxazolo[3,4-d]pyrazolo[3,4-b]pyridines, method for their preparation and use as anxiolytic agents HOECHST-ROUSSEL PHARMACEUTICALS (US) 1986-11-25 US disclosed
US-4622326-A 6H-isoxazolo(5,4-d)pyrazolo(3,4-b)pyridines, and their use as antihypertensive and analgesic agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1986-11-11 US disclosed