SCHEMBL8501860

SCHEMBL8501860

CCCCCCCCCc1cccc(O)c1CCCCCCCCC.CCCCCCCCc1ccccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.56
MCL1 Q07820 3/20 0.56
KAT8 Q9H7Z6 3/20 0.56
BCL2L1 Q07817 2/20 0.56
BAK1 Q16611 2/20 0.56
SAE1 Q9UBE0 2/20 0.56
EP300 Q09472 2/20 0.56
KAT5 Q92993 2/20 0.56
PPARG P37231 1/20 0.56
PPARA Q07869 1/20 0.56
KAT2A Q92830 1/20 0.56
KAT2B Q92831 1/20 0.56
LIPG Q9Y5X9 1/20 0.53
TYR P14679 2/20 0.51
MAPT P10636 2/20 0.51
ALOX15 P16050 2/20 0.51
ALOX5 P09917 2/20 0.51
MEN1 O00255 1/20 0.51
TP53 P04637 1/20 0.51
CYP3A4 P08684 1/20 0.51

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
SCHEMBL7513928 1.00 BID (0.56) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL10921839 1.00 BID (0.56) BIDMCL1KAT8BCL2L1BAK1
Formaldehyde SCHEMBL7025409 0.95 BID (0.56) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL984157 0.95 BID (0.61) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL632247 0.95 BID (0.61) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL980283 0.95 BID (0.61) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL984168 0.95 BID (0.61) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL982154 0.95 BID (0.61) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL982794 0.95 BID (0.61) BIDMCL1KAT8BCL2L1BAK1
SCHEMBL1003820 0.95 BID (0.61) BIDMCL1KAT8BCL2L1BAK1

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-5992354-A Combustion of nanopartitioned fuel MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1999-11-30 US disclosed