SCHEMBL9457940

SCHEMBL9457940

CC(C)(C)CC(C(=O)Oc1ccc(C(=O)c2ccccc2)c(O)c1)c1ccc(O)c(C(C)(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.47
LMNA P02545 3/20 0.47
MAPK1 P28482 2/20 0.47
CYP1A2 P05177 2/20 0.47
PGR P06401 2/20 0.47
SLC6A2 P23975 2/20 0.47
CYP2C19 P33261 2/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP2D6 P10635 1/20 0.47
PDE4A P27815 1/20 0.47
HRH1 P35367 1/20 0.47
HTT P42858 1/20 0.47
SLC6A3 Q01959 1/20 0.47
PDE4D Q08499 1/20 0.47
GAA P10253 2/20 0.43
ATM Q13315 2/20 0.43
XBP1 P17861 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 3/20 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
SCHEMBL9458191 0.91 ATM (0.43) HPGDLMNAMAPK1CYP1A2PGR
SCHEMBL9458229 0.82 GAA (0.37) HPGDLMNAMAPK1CYP1A2PGR
SCHEMBL9457950 0.80 HPGD (0.47) HPGDLMNAMAPK1CYP1A2PGR
SCHEMBL9457926 0.79 HPGD (0.52) HPGDLMNAMAPK1CYP1A2PGR
SCHEMBL28876789 0.75 ATM (0.64) ALDH1A1GAAATMXBP1NPSR1
SCHEMBL1871824 0.75 ATM (0.41) LMNAALDH1A1HTTGAAATM
SCHEMBL28853653 0.74 ATM (0.43) LMNACYP2C19ALDH1A1CYP2D6HTT
SCHEMBL1278439 0.73 ALDH1A1 (0.43) LMNACYP1A2ALDH1A1HTTGAA
SCHEMBL5401921 0.73 ATM (0.39) LMNAALDH1A1HTTGAAATM
Ethylene SCHEMBL29280305 0.73 ATM (0.61) ALDH1A1GAAATMXBP1NPSR1

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-5274170-A Substituted benzophenone stabilizers CIBA-GEIGY CORPORATION (US) 1993-12-28 US disclosed