SCHEMBL9458223

SCHEMBL9458223

CC(C)c1cc(C(C)C(=O)Oc2ccc(C(=O)c3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)c(O)c2)cc(C(C)(C)C)c1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 2/20 0.37
MCL1 Q07820 2/20 0.37
HPGD P15428 3/20 0.37
LMNA P02545 2/20 0.37
CYP1A2 P05177 2/20 0.37
PGR P06401 2/20 0.37
SLC6A2 P23975 2/20 0.37
CYP2C19 P33261 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP2D6 P10635 1/20 0.37
PDE4A P27815 1/20 0.37
MAPK1 P28482 1/20 0.37
HRH1 P35367 1/20 0.37
HTT P42858 1/20 0.37
SLC6A3 Q01959 1/20 0.37
PDE4D Q08499 1/20 0.37
ALOX5 P09917 1/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
GAA P10253 2/20 0.36

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
SCHEMBL9458187 0.94 HPGD (0.41) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL9457926 0.87 HPGD (0.52) BCL2MCL1HPGDLMNACYP1A2
SCHEMBL9458229 0.81 GAA (0.37) BCL2MCL1HPGDLMNACYP1A2
SCHEMBL8744589 0.79 GAA (0.39) BCL2MCL1HPGDLMNACYP1A2
SCHEMBL9457384 0.78 ALOX5 (0.41) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL8744623 0.77 NR1H4 (0.51) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL9458233 0.77 ELANE (0.38) BCL2MCL1HPGDLMNACYP1A2
SCHEMBL9458191 0.76 ATM (0.43) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL29020567 0.75 CA2 (0.49) CYP1A2ALDH1A1CYP2D6HTTGAA
SCHEMBL8744640 0.73 ELANE (0.43) HPGDLMNACYP1A2PGRSLC6A2

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
US-5274170-A Substituted benzophenone stabilizers CIBA-GEIGY CORPORATION (US) 1993-12-28 US disclosed
US-5145766-A Benzoyl esters or sulfonates CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed