SCHEMBL7522360

SCHEMBL7522360

Cc1ccc2c(c1)C(C)(C)CC1(CC(C)(C)c3cc(C)ccc3O1)O2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.34
MMP12 P39900 1/20 0.34
HTT P42858 3/20 0.33
ATM Q13315 2/20 0.33
FTO Q9C0B1 1/20 0.33
CYP26A1 O43174 1/20 0.33
CYP26B1 Q9NR63 1/20 0.33
AKR1B1 P15121 2/20 0.33
HTR1A P08908 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RAD52 P43351 1/20 0.32
LMNA P02545 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL7524572 0.93 FTO (0.33) KDM4EMMP12HTTATMFTO
SCHEMBL7525432 0.85 KDM4E (0.34) KDM4EMMP12HTTATMFTO
SCHEMBL10100884 0.80
SCHEMBL9291596 0.80 MAPT (0.41) KDM4EHTTFTOALDH1A1MAPT
SCHEMBL12352021 0.78 DRD1 (0.35)
SCHEMBL7525551 0.77 FTO (0.54) KDM4EHTTATMFTOAKR1B1
SCHEMBL7523777 0.77 FTO (0.38) FTO
SCHEMBL7520930 0.76 FTO (0.52) KDM4EATMFTOAKR1B1SLC6A2
SCHEMBL13668278 0.75 KDM4E (0.43) KDM4EAKR1B1MAPTRXRA
SCHEMBL13668353 0.75 RXRA (0.53) CYP26A1CYP26B1ALDH1A1RXRATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0738723-B1 Method for making polyalkylated xanthenes GEN ELECTRIC (US) 2002-03-13 EP disclosed
EP-0738723-A2 Method for making polyalkylated xanthenes GENERAL ELECTRIC COMPANY (US) 1996-10-23 EP disclosed
US-5554770-A Method for making polyalkylated xanthenes GENERAL ELECTRIC COMPANY (US) 1996-09-10 US disclosed