SCHEMBL10698413

SCHEMBL10698413

CCCCCCCCc1cccc(C(=O)O)c1OOCCOc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.47
PLK1 P53350 1/20 0.47
ALDH1A1 P00352 1/20 0.45
PPARA Q07869 3/20 0.44
BID P55957 3/20 0.44
MCL1 Q07820 3/20 0.44
BCL2L1 Q07817 2/20 0.44
BAK1 Q16611 2/20 0.44
KAT8 Q9H7Z6 2/20 0.44
PPARG P37231 2/20 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
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
PLA2G4B P0C869 2/20 0.44
FAAH O00519 1/20 0.42

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
SCHEMBL10698355 0.95 ALDH1A1 (0.47) PTPN11PLK1ALDH1A1TP53TSHR
SCHEMBL11769161 0.82 BID (0.51) PTPN11PLK1PPARABIDMCL1
SCHEMBL6151348 0.82 BID (0.51) PTPN11PLK1PPARABIDMCL1
SCHEMBL472738 0.82 BID (0.51) PTPN11PLK1PPARABIDMCL1
SCHEMBL11773602 0.82 BID (0.51) PTPN11PLK1PPARABIDMCL1
SCHEMBL7078027 0.81 BID (0.54) PTPN11PPARABIDMCL1BCL2L1
SCHEMBL11868801 0.81 BID (0.54) PTPN11PPARABIDMCL1BCL2L1
SCHEMBL5453797 0.81 BID (0.54) PTPN11PPARABIDMCL1BCL2L1
SCHEMBL2049435 0.81 BID (0.54) PTPN11PPARABIDMCL1BCL2L1
SCHEMBL2374613 0.81 BID (0.54) PTPN11PPARABIDMCL1BCL2L1

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
EP-0275203-A2 Heat-sensitive recording material containing color forming components FUJI PHOTO FILM CO., LTD. (JP) 1988-07-20 EP disclosed