SCHEMBL12207267

SCHEMBL12207267

Cc1oc2ccc(OCc3ccc(F)cc3)cc2c(=O)c1O

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.68
HTT P42858 1/20 0.68
MAOB P27338 7/20 0.57
ACHE P22303 2/20 0.57
ANO1 Q5XXA6 3/20 0.55
MAOA P21397 5/20 0.55
SLC26A4 O43511 3/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
BLM P54132 1/20 0.53
ATM Q13315 1/20 0.53
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
PKM P14618 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
AR P10275 1/20 0.48
SLC16A3 O15427 1/20 0.47

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
SCHEMBL756334 0.84 HTT (0.57) LMNAHTTMAOBACHEANO1
SCHEMBL751538 0.84 LMNA (0.62) LMNAHTTMAOBACHEANO1
SCHEMBL24470810 0.81 LMNA (1.00) LMNAHTTANO1SLC26A4KMT2A
SCHEMBL29712989 0.81 LMNA (1.00) LMNAHTTANO1SLC26A4KMT2A
SCHEMBL756497 0.81 LMNA (0.51) LMNAHTTMAOBACHEANO1
SCHEMBL765549 0.79 ANO1 (0.52) LMNAHTTMAOBACHEANO1
SCHEMBL754620 0.79 ANO1 (0.48) LMNAHTTMAOBACHEANO1
SCHEMBL3221505 0.75 LMNA (0.60) LMNAHTTMAOBACHEANO1
SCHEMBL3225947 0.75 LMNA (0.57) LMNAHTTMAOBACHEANO1
SCHEMBL6593795 0.73 MAOB (0.55) LMNAHTTMAOBACHEANO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3042894-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2016-07-13 EP disclosed
EP-2181985-B1 Antiviral Agent SHIONOGI & CO (JP) 2011-10-26 EP disclosed
EP-2181985-A1 Antiviral Agent SHIONOGI & CO., LTD. (JP) 2010-05-05 EP disclosed