SCHEMBL7061561

SCHEMBL7061561

COc1cccc(O)c1C(=O)c1ccccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.53
AR P10275 2/20 0.53
CYP3A4 P08684 2/20 0.53
HPGD P15428 2/20 0.53
ALOX15 P16050 2/20 0.53
CYP1A2 P05177 1/20 0.53
PGR P06401 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
CHRM1 P11229 1/20 0.53
TBXA2R P21731 1/20 0.53
SLC6A2 P23975 1/20 0.53
CYP2C19 P33261 1/20 0.53
ADRA1A P35348 1/20 0.53
HIF1A Q16665 1/20 0.53
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
TP53 P04637 2/20 0.52
TSHR P16473 2/20 0.52
CA12 O43570 2/20 0.52
CA7 P43166 2/20 0.52

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
SCHEMBL23361672 0.86 CA1 (0.52) LMNAARCYP3A4HPGDALOX15
SCHEMBL11740819 0.84 CA1 (0.58) LMNACYP3A4HPGDALOX15CYP1A2
SCHEMBL4060271 0.84 LMNA (0.62) LMNAARCYP3A4HPGDALOX15
SCHEMBL489859 0.83 ALOX15 (0.60) LMNAARCYP3A4HPGDALOX15
SCHEMBL29120698 0.81 LMNA (0.55) LMNAARCYP3A4HPGDALOX15
SCHEMBL8861227 0.81 LIG1 (0.57) LMNAARCYP3A4HPGDALOX15
SCHEMBL28516342 0.80 CA12 (0.62) CA1CA2CA12CA7CA9
SCHEMBL7332022 0.80 CYP3A4 (0.62) LMNAARCYP3A4HPGDALOX15
SCHEMBL7061596 0.80 CTNNB1 (0.51) LMNAARCYP3A4HPGDALOX15
SCHEMBL7338027 0.80 NPC1 (0.59) LMNAARCYP3A4HPGDALOX15

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-1016648-B1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES ASAHI CHEMICAL IND (JP) 2003-05-14 EP disclosed
US-6262210-B1 TRANSESTERIFYING DIALKYL CARBONATE, ALKYL ARYL CARBONATE OR MIXTURE WITH AROMATIC MONOHYDROXY COMPOUND IN PRESENCE OF METAL CONTAINING CATALYST TO OBTAIN HIGH BOILING POINT REACTION MIXTURE CONTAINING AROMATIC CARBONATE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-07-17 US disclosed
EP-1016648-A1 PROCESS FOR THE PREPARATION OF AROMATIC CARBONATES Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-07-05 EP disclosed