SCHEMBL8773573

SCHEMBL8773573

C#COc1ccccc1OCc1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
MAPT P10636 3/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
APP P05067 2/20 0.46
MAOB P27338 3/20 0.45
MAOA P21397 1/20 0.45
CARM1 Q86X55 2/20 0.45
PRMT1 Q99873 2/20 0.45
LMNA P02545 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43

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
SCHEMBL8773563 0.83 RXRA (0.46) MAPTMAPK1TDP1L3MBTL1ALDH1A1
SCHEMBL8773537 0.80 PTPN1 (0.52) MAOBRXRARXRBRXRGLIPE
SCHEMBL11083620 0.77 MAPT (0.52) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL31556117 0.77 HPGD (0.61) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL7606605 0.77 RXRA (0.65) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL8773569 0.76 MAOB (0.54) MAPTMAPK1ALDH1A1SMN1; SMN2APP
SCHEMBL12908047 0.74 MAPT (0.52) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL11091137 0.74 APP (0.69) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL31556121 0.74 APP (0.54) HTR1AADRA1DADRA1AADRA1BMAPT
SCHEMBL28931748 0.74 MAPT (0.52) HTR1AADRA1DADRA1AADRA1BMAPT

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-0577555-B1 Derivatives of carboxylic acids CIBA GEIGY AG (CH) 1997-11-05 EP claimed