SCHEMBL6968908

SCHEMBL6968908

COc1cccc(/C=C2\Oc3cc(OC(=O)c4ccccc4)ccc3C2=O)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.70
KMT2A Q03164 5/20 0.70
ALDH1A1 P00352 3/20 0.70
USP2 O75604 2/20 0.70
BCL2L1 Q07817 1/20 0.70
MCL1 Q07820 1/20 0.70
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
MAOB P27338 3/20 0.60
PTGS2 P35354 1/20 0.59
MAPT P10636 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
LMNA P02545 1/20 0.59
NTSR1 P30989 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
KDM4E B2RXH2 1/20 0.58
PLIN1 O60240 1/20 0.58
TNNI3 P19429 1/20 0.58
TNNT2 P45379 1/20 0.58
TNNC1 P63316 1/20 0.58

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
SCHEMBL6968912 1.00 MEN1 (0.70) MEN1KMT2AALDH1A1USP2BCL2L1
SCHEMBL6967035 0.92 ALDH1A1 (0.72) MEN1KMT2AALDH1A1USP2BCL2L1
SCHEMBL6967040 0.92 ALDH1A1 (0.72) MEN1KMT2AALDH1A1USP2BCL2L1
SCHEMBL6969430 0.91 ALDH1A1 (0.77) MEN1KMT2AALDH1A1USP2BCL2L1
SCHEMBL6969428 0.91 ALDH1A1 (0.77) MEN1KMT2AALDH1A1USP2BCL2L1
SCHEMBL6969478 0.87 MEN1 (0.67) MEN1KMT2AALDH1A1USP2NPC1
SCHEMBL6969482 0.87 MEN1 (0.67) MEN1KMT2AALDH1A1USP2NPC1
SCHEMBL6957794 0.87 MAOB (0.78) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL6957789 0.87 MAOB (0.78) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL6966060 0.87 CSNK2A2 (0.69) MEN1KMT2AALDH1A1USP2BCL2L1

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