SCHEMBL2015276

SCHEMBL2015276

CCn1c(CO)nc2ccc(-c3ccc(O)cc3)cc21

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.49
RPS6KA5 O75582 1/20 0.41
ACSS2 Q9NR19 2/20 0.39
AAK1 Q2M2I8 2/20 0.38
TNF P01375 1/20 0.38
TSHR P16473 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37

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
SCHEMBL2015354 0.85 PPARG (0.52) PPARGACSS2TSHRKDM4EGAA
SCHEMBL2019390 0.81 BACE1 (0.41) PPARGRPS6KA5ACSS2AAK1TNF
SCHEMBL2018088 0.79 TNF (0.53) ACSS2TNFTSHRKDM4EPOLB
SCHEMBL2013679 0.78 PPARG (0.45) PPARGACSS2TNFTSHRKDM4E
SCHEMBL2020767 0.78 ACSS2 (0.54) ACSS2TNFTSHRKDM4EGAA
SCHEMBL2020983 0.76 LMNA (0.50) PPARGTSHRGAAMAPT
SCHEMBL2020612 0.75 ACSS2 (0.56) ACSS2POLBMAPT
SCHEMBL2020859 0.74 TDP1 (0.53) PPARGRPS6KA5TSHRKDM4EPOLB
SCHEMBL2017366 0.73 POLB (0.64) TNFTSHRKDM4EPOLBGAA
SCHEMBL2018235 0.71 ACSS2 (0.38) ACSS2TNFTSHRKDM4EPOLB

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
WO-2011079087-A1 ENAC BLOCKERS GLAXO GROUP LIMITED (GB) 2011-06-30 WO disclosed
WO-2011079087-A1 ENAC BLOCKERS GLAXO GROUP LIMITED (GB) 2011-06-30 WO disclosed