SCHEMBL3666856

SCHEMBL3666856

C=CCOc1ccc2oc(-c3ccc(F)cc3)c(C(=O)OC)c2c1.C=CCc1c(O)ccc2oc(-c3ccc(F)cc3)c(C(=O)OC)c12

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 9/20 0.48
RCE1 Q9Y256 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
ATM Q13315 1/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL3628304 0.89 ANO1 (0.57) ANO1RCE1MEN1KMT2AMAPT
SCHEMBL3632851 0.88 GAA (0.42) ANO1MEN1KMT2AMAPTL3MBTL1
SCHEMBL3633969 0.76 ANO1 (0.57) ANO1RCE1MEN1KMT2AMAPT
SCHEMBL3534397 0.76 L3MBTL1 (0.65) ANO1RCE1MEN1KMT2AMAPT
SCHEMBL3631501 0.74 GAA (0.42) ANO1MEN1KMT2AMAPTL3MBTL1
SCHEMBL2294314 0.73 MEN1 (0.62) ANO1RCE1MEN1KMT2AMAPT
SCHEMBL2294234 0.73 L3MBTL1 (0.55) ANO1RCE1MEN1KMT2AMAPT
SCHEMBL17652429 0.72 KCNH2 (0.42)
SCHEMBL2404910 0.69 ATM (0.52) ANO1RCE1MEN1KMT2AMAPT
SCHEMBL29852823 0.69 ATM (0.52) ANO1RCE1MEN1KMT2AMAPT

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-2146999-A1 BENZOFURAN- CARBOXAMIDE DERIVATIVES AS ANTIVIRAL AGENTS Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2010-01-27 EP disclosed
WO-2008125874-A1 BENZOFURAN- CARBOXAMIDE DERIVATIVES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2008-10-23 WO disclosed