SCHEMBL8540203

SCHEMBL8540203

CCCCC(CC)(c1ccc(Oc2ccccc2N)cc1)c1ccc(Oc2ccccc2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
GAA P10253 2/20 0.42
RCE1 Q9Y256 1/20 0.42
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
IKBKB O14920 1/20 0.40
BRAF P15056 1/20 0.40
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
MAPT P10636 3/20 0.40
ATM Q13315 2/20 0.40
LMNA P02545 1/20 0.40
LTA4H P09960 3/20 0.39
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.36
MRGPRX1 Q96LB2 1/20 0.36
TLR4 O00206 1/20 0.35

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
SCHEMBL8540562 0.94 CYP1A2 (0.53) CYP1A2CYP2C9CYP2C19GAARCE1
SCHEMBL8539825 0.92 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19GAARCE1
SCHEMBL8535860 0.92 CYP1A2 (0.45) CYP1A2CYP2C9CYP2C19GAARCE1
SCHEMBL8956034 0.89 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19GAARCE1
SCHEMBL8539875 0.88 GAA (0.49) CYP1A2CYP2C9CYP2C19GAARCE1
SCHEMBL8540229 0.85 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19GAARCE1
SCHEMBL6363969 0.84 CYP1A2 (0.51) CYP1A2CYP2C9CYP2C19GAARCE1
SCHEMBL8540208 0.81 MAPT (0.58) CYP1A2CYP2C9CYP2C19GAAESR1
SCHEMBL6367620 0.81 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19GAARCE1
SCHEMBL6363523 0.80 CYP1A2 (0.49) CYP1A2CYP2C9CYP2C19GAARCE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5714209-A TWO SUBSTRATE PROVIDED WITH RUBBED POLYIMIDE ALIGNMENT FILM; PROVIDES HIGH QUALITY DISPLAY WITH HIGH CONTRAST, FREE FROM UNPLEASANT AFTER-IMAGE CANON KABUSHIKI KAISHA (JP) 1998-02-03 US disclosed
US-5626925-A POLYIMIDE ADJUSTMENT FILM CANON KABUSHIKI KAISHA (JP) 1997-05-06 US disclosed
US-5571580-A POLYAMIDE COMPOSITE CANON KABUSHIKI KAISHA (JP) 1996-11-05 US disclosed
US-5552193-A Liquid crystal device CANON KABUSHIKI KAISHA (JP) 1996-09-03 US disclosed
US-5464668-A Polyamideimide substrate with naphthalenetetracarboxylic acid and bis(4-aminophenoxyphenyl)alkane monomers CANON KABUSHIKI KAISHA (JP) 1995-11-07 US disclosed
US-5419931-A Polyamide alignment film CANON KABUSHIKI KAISHA (JP) 1995-05-30 US disclosed