SCHEMBL6903069

SCHEMBL6903069

c1ccc(C2CC(c3ccccc3)C(c3ccccc3)C2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.56
HTR2C P28335 8/20 0.56
MAOA P21397 7/20 0.56
KDM1A O60341 5/20 0.56
CYP2C19 P33261 4/20 0.56
CYP2B6 P20813 3/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2D6 P10635 2/20 0.56
CYP2C9 P11712 2/20 0.56
LMNA P02545 2/20 0.56
TAAR1 Q96RJ0 2/20 0.56
CYP3A4 P08684 1/20 0.56
HTR1A P08908 1/20 0.56
ADRA2A P08913 1/20 0.56
CYP2A6 P11509 1/20 0.56
SLC6A2 P23975 1/20 0.56
ADRA1A P35348 1/20 0.56
DRD3 P35462 1/20 0.56
SLC6A3 Q01959 1/20 0.56
KCNH2 Q12809 1/20 0.56

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
SCHEMBL21553355 1.00 MAOB (0.56) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL28632233 0.87 DEGS1 (0.47) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL8845464 0.85 MAOB (0.65) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL10540521 0.85 MAOB (0.65) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL2261976 0.85 MAOB (0.65) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL2766491 0.85 SLC18A3 (0.52) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL11661537 0.85 SLC18A3 (0.52) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL8594883 0.76 SLC18A3 (0.44) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL14861174 0.76 MAOB (0.54) MAOBHTR2CMAOAKDM1ACYP2C19
SCHEMBL1625735 0.76 SLC18A3 (0.47) MAOBHTR2CMAOAKDM1ACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6759498-B2 Continuous anionic polymerization of mixtures comprising aromatic olefins, solvents and organolithium compounds, to form polymers having narrow molecular weight distribution and heat resistance used as packaging containers ASAHI KADEI KABUSHIKI KAISHA (JP) 2004-07-06 US disclosed
US-20030181610-A1 Process for producing styrene resin reduced in content of low-molecular ingredient ASAHI KASEI KABUSHIKI KAISHA (JP) 2003-09-25 US disclosed