SCHEMBL6956101

SCHEMBL6956101

CCC(=O)Oc1ccc2c(c1)O/C(=C\c1cc(OC)cc(OC)c1)C2=O

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.66
KDM4E B2RXH2 2/20 0.66
MEN1 O00255 2/20 0.66
USP2 O75604 2/20 0.66
KMT2A Q03164 2/20 0.66
POLB P06746 1/20 0.66
MAOB P27338 4/20 0.61
PPARG P37231 1/20 0.58
PPARD Q03181 1/20 0.58
KIT P10721 1/20 0.57
STK17B O94768 1/20 0.56
ALDH1A1 P00352 1/20 0.56
PKM P14618 1/20 0.56
MAPK1 P28482 1/20 0.56
RECQL P46063 1/20 0.55

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
SCHEMBL6956102 1.00 PTGS2 (0.66) PTGS2KDM4EMEN1USP2KMT2A
SCHEMBL6959318 0.92 MAOB (0.73) PTGS2KDM4EMEN1USP2KMT2A
SCHEMBL6959317 0.92 MAOB (0.73) PTGS2KDM4EMEN1USP2KMT2A
SCHEMBL6967086 0.90 MEN1 (0.65) PTGS2KDM4EMEN1USP2KMT2A
SCHEMBL6967079 0.90 MEN1 (0.65) PTGS2KDM4EMEN1USP2KMT2A
SCHEMBL6963133 0.87 MEN1 (0.71) PTGS2KDM4EMEN1USP2KMT2A
SCHEMBL6963130 0.87 MEN1 (0.71) PTGS2KDM4EMEN1USP2KMT2A
SCHEMBL6969078 0.86 MEN1 (0.71) KDM4EMEN1USP2KMT2APOLB
SCHEMBL6969074 0.86 MEN1 (0.71) KDM4EMEN1USP2KMT2APOLB
SCHEMBL6963412 0.84 MEN1 (0.63) PTGS2KDM4EMEN1USP2KMT2A

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-0902022-B1 NOVEL BENZOFURANONE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME DAIICHI SEIYAKU CO (JP) 2003-07-30 EP disclosed
US-6143779-A Benzofuranone derivatives and a method for producing them SNOW BRAND MILK PRODUCTS CO., LTD. (JP) 2000-11-07 US disclosed
EP-0902022-A1 NOVEL BENZOFURANONE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SNOW BRAND MILK PRODUCTS CO., LTD. (JP) 1999-03-17 EP disclosed