SCHEMBL9863155

SCHEMBL9863155

OCCCCCCc1cccc(O)c1O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IAPP P10997 4/20 0.50
BID P55957 4/20 0.44
MCL1 Q07820 4/20 0.44
BCL2L1 Q07817 3/20 0.44
BAK1 Q16611 3/20 0.44
KAT8 Q9H7Z6 2/20 0.44
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
EP300 Q09472 1/20 0.44
KAT2A Q92830 1/20 0.44
KAT2B Q92831 1/20 0.44
KAT5 Q92993 1/20 0.44
SAE1 Q9UBE0 1/20 0.44

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
SCHEMBL9863325 1.00 IAPP (0.50) IAPPBIDMCL1BCL2L1BAK1
SCHEMBL30810444 0.92 IAPP (0.53) IAPP
SCHEMBL1236262 0.92 IAPP (0.53) IAPP
SCHEMBL10414030 0.89 IAPP (0.59) IAPPBIDMCL1BCL2L1BAK1
SCHEMBL9153692 0.87 ALOX5 (0.47) IAPPBIDMCL1BCL2L1BAK1
SCHEMBL8055362 0.83 MGLL (0.58) BIDMCL1BCL2L1BAK1
SCHEMBL13446845 0.83 MGLL (0.58) BIDMCL1BCL2L1BAK1
SCHEMBL8526141 0.83 MGLL (0.58) BIDMCL1BCL2L1BAK1
SCHEMBL8618791 0.83 MGLL (0.58) BIDMCL1BCL2L1BAK1
SCHEMBL10522207 0.83 MGLL (0.58) BIDMCL1BCL2L1BAK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5025036-A Antiinflammatory agents, gastrointestinal, cardiovascular and skin disorders HOFFMANN-LA ROCHE INC. (US) 1991-06-18 US disclosed