SCHEMBL9079873

SCHEMBL9079873

COCCOCOc1ccc(CO)nc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.39
CBFB Q13951 1/20 0.38
KDM4E B2RXH2 1/20 0.35
RECQL P46063 1/20 0.35
FYN P06241 2/20 0.34
CHEK2 O96017 1/20 0.34
AOC2 O75106 1/20 0.33
NOTUM Q6P988 1/20 0.33
F2 P00734 1/20 0.32
ELANE P08246 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL20745405 0.89 CBFB (0.43) CBFBKDM4ERECQLCHEK2HRH3
SCHEMBL17544106 0.87 CBFB (0.46) CBFBCHEK2HRH3
SCHEMBL12036832 0.85 FYN (0.40) CBFBFYNNOTUMSLC6A3HRH3
SCHEMBL9079842 0.84 CTNNB1 (0.36) CTNNB1KDM4ERECQLCHEK2HRH3
SCHEMBL8895538 0.83 CTNNB1 (0.35) CTNNB1CBFBKDM4ERECQLCHEK2
SCHEMBL23530082 0.82 HRH3 (0.40) CBFBHRH3
SCHEMBL8894008 0.78 PPARG (0.40) CTNNB1F2ELANE
SCHEMBL10745619 0.78 CTNNB1 (0.43) CTNNB1CBFBKDM4ERECQLFYN
SCHEMBL11384767 0.78 NCF1 (0.43) CBFBKDM4ERECQLNOTUMHRH3
SCHEMBL8893687 0.76 CTNNB1 (0.34) CTNNB1KDM4ERECQLAOC2

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-0737195-A1 NEW GINKGOLIDE DERIVATIVES AND A PROCESS FOR PREPARING THEM SUNKYONG INDUSTRIES CO., LTD. (KR) 1996-10-16 EP disclosed
US-5541183-A RESPIRATORY SYSTEM DISORDERS, SKIN DISORDERS AND PLATELET ACTIVATING FACTOR ANTAGONIST SUNKYONG INDUSTRIES CO., LTD. (KR) 1996-07-30 US disclosed
WO-1995018131-A1 NEW GINKGOLIDE DERIVATIVES AND A PROCESS FOR PREPARING THEM SUNKYONG INDUSTRIES CO., LTD. (KR) 1995-07-06 WO disclosed