SCHEMBL5819940

SCHEMBL5819940

CCCCCCCCCCCCCCCCOc1ccc([C](c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.60
TSHR P16473 1/20 0.60
PLA2G4B P0C869 6/20 0.59
LTA4H P09960 2/20 0.57
RARB P10826 3/20 0.56
NR5A1 Q13285 1/20 0.54
MLNR O43193 1/20 0.54
NR1I2 O75469 1/20 0.54
ESR1 P03372 1/20 0.54
NR3C1 P04150 1/20 0.54
PGR P06401 1/20 0.54
ADRB2 P07550 1/20 0.54
CHRM2 P08172 1/20 0.54
ADRB1 P08588 1/20 0.54
HTR1A P08908 1/20 0.54
ADRA2A P08913 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
CHRM1 P11229 1/20 0.54
DRD2 P14416 1/20 0.54
ADRA2B P18089 1/20 0.54

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
SCHEMBL5816099 1.00 TP53 (0.60) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL5819931 1.00 TP53 (0.60) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL5814527 0.94 TP53 (0.68) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL4800576 0.94 TP53 (0.63) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL5820211 0.94 TP53 (0.68) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL4798961 0.94 TP53 (0.68) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL4796415 0.94 TP53 (0.63) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL382628 0.94 TP53 (0.68) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL382171 0.94 TP53 (0.68) TP53TSHRPLA2G4BLTA4HRARB
SCHEMBL4799801 0.94 TP53 (0.63) TP53TSHRPLA2G4BLTA4HRARB

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
WO-2006132588-A1 METHOD FOR THE PURIFICATION OF SYNTHETIC OLIGONUCLEOTIDES CONTAINING ONE OR SEVERAL LABELS QUIATECH AB (SE) 2006-12-14 WO claimed
WO-2006132588-A1 METHOD FOR THE PURIFICATION OF SYNTHETIC OLIGONUCLEOTIDES CONTAINING ONE OR SEVERAL LABELS QUIATECH AB (SE) 2006-12-14 WO disclosed