SCHEMBL9833982

SCHEMBL9833982

CCn1ncc2c(Cl)c(C(=O)c3cccc(Cl)c3)cnc21

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 15/20 0.57
PDE4B Q07343 4/20 0.52
PGR P06401 1/20 0.52
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PDE5A O76074 1/20 0.42

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
SCHEMBL9835196 0.90 NR3C1 (0.67) NR3C1PDE4BPGRPDE5A
SCHEMBL10758282 0.90 NR3C1 (0.48) NR3C1PDE4BPGRRAB9ASMN1; SMN2
SCHEMBL9833383 0.89 NR3C1 (0.55) NR3C1PDE4BPGRPDE5A
SCHEMBL9835965 0.88 NR3C1 (0.60) NR3C1PDE4BPGRPDE5A
SCHEMBL9833323 0.87 NR3C1 (0.53) NR3C1PDE4BPGRRAB9APDE5A
SCHEMBL9835287 0.86 NR3C1 (0.67) NR3C1PDE4BPGR
SCHEMBL9834161 0.82 PDE4B (0.60) NR3C1PDE4BPGRPDE5A
SCHEMBL9836172 0.81 NR3C1 (0.55) NR3C1PDE4BPGRPDE5A
SCHEMBL9835355 0.80 PDE4B (0.55) NR3C1PDE4BPGRSMN1; SMN2PDE5A
SCHEMBL9834976 0.79 NR3C1 (0.67) 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 2 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
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