SCHEMBL10399449

SCHEMBL10399449

Cc1ccc(COc2ccc(O)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.66
APP P05067 2/20 0.66
LMNA P02545 1/20 0.64
CYP1A2 P05177 1/20 0.64
PTGS1 P23219 1/20 0.64
SLC6A2 P23975 1/20 0.64
CYP2C19 P33261 1/20 0.64
PTGS2 P35354 1/20 0.64
SLC6A3 Q01959 1/20 0.64
HIF1A Q16665 1/20 0.64
HDAC6 Q9UBN7 1/20 0.64
PARP10 Q53GL7 1/20 0.64
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
CASP3 P42574 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
SENP8 Q96LD8 1/20 0.62
SENP7 Q9BQF6 1/20 0.62
SENP6 Q9GZR1 1/20 0.62
MAPT P10636 2/20 0.60

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
SCHEMBL21699890 1.00 MAOB (0.66) MAOBAPPLMNACYP1A2PTGS1
SCHEMBL8929713 0.91 MAOB (0.69) MAOBAPPPARP10NPC1RAB9A
SCHEMBL762195 0.91 MAOB (0.69) MAOBAPPPARP10NPC1RAB9A
SCHEMBL891195 0.91 MAOB (0.69) MAOBAPPPARP10NPC1RAB9A
SCHEMBL8930213 0.91 MAOB (0.69) MAOBAPPPARP10NPC1RAB9A
SCHEMBL5633306 0.89 APP (0.79) APPLMNACYP1A2PTGS1SLC6A2
SCHEMBL11578826 0.89 APP (0.79) APPLMNACYP1A2PTGS1SLC6A2
SCHEMBL420238 0.87 MAOB (0.56) MAOBAPPLMNACYP1A2PTGS1
SCHEMBL4054115 0.86 MAOB (0.64) MAOBAPPLMNAPARP10NPC1
SCHEMBL8991100 0.86 MAOB (0.64) MAOBAPPLMNAPARP10NPC1

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
US-4952661-A AND DICARBOXYLIC AROMATIC ACID, AND OPTIONALLY A HYDROQUINONE; ANISOTROPIC MONTEDISON S.P.A. (IT) 1990-08-28 US claimed
EP-0300752-A2 Thermotropic liquid crystalline polyesters Montedison S.p.A. (IT) 1989-01-25 EP claimed
US-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed