SCHEMBL13846352

SCHEMBL13846352

Bc1cccc(-c2cc(C(O)c3ccc(F)cc3)cc3sc(NC(=O)OC(C)(C)C)nc23)c1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LCK P06239 12/20 0.39
MAPT P10636 1/20 0.34
SCN9A Q15858 1/20 0.34
PARP14 Q460N5 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL2926337 0.91 LCK (0.39) LCKMAPT
SCHEMBL2910691 0.90 LCK (0.40) LCKMAPTSCN9AKMT2A
SCHEMBL2915053 0.87 MAPT (0.41) LCKMAPTKMT2A
SCHEMBL13846345 0.85 LCK (0.44) LCKPARP14KMT2A
SCHEMBL8077962 0.83 CFTR (0.40) LCKMAPTKMT2A
SCHEMBL2920262 0.81 LCK (0.44) LCKMAPTPARP14
SCHEMBL13846351 0.80 LCK (0.43) LCKMAPT
SCHEMBL13846349 0.79 LCK (0.42) LCKMAPT
SCHEMBL2940199 0.73 CFTR (0.38) LCKMAPTKMT2A
SCHEMBL2940202 0.71 CFTR (0.38) LCKMAPTKMT2A

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
WO-2009067604-A1 SUBSTITUTED BENZOAZOLE PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS DECODE GENETICS EHF (IS) 2009-05-28 WO disclosed
WO-2009067618-A1 SUBSTITUTED BENZOAZOLE PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS DECODE GENETICS EHF (IS) 2009-05-28 WO disclosed