SCHEMBL9304906

SCHEMBL9304906

CCCCCCCCCCCCCCCCOc1ccc(C(Cl)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.60
NR5A1 Q13285 1/20 0.53
TP53 P04637 1/20 0.51
TSHR P16473 1/20 0.51
PLA2G4B P0C869 1/20 0.50
MLNR O43193 1/20 0.49
NR1I2 O75469 1/20 0.49
ESR1 P03372 1/20 0.49
NR3C1 P04150 1/20 0.49
PGR P06401 1/20 0.49
ADRB2 P07550 1/20 0.49
CHRM2 P08172 1/20 0.49
ADRB1 P08588 1/20 0.49
HTR1A P08908 1/20 0.49
ADRA2A P08913 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
CHRM1 P11229 1/20 0.49
DRD2 P14416 1/20 0.49
ADRA2B P18089 1/20 0.49
ADRA2C P18825 1/20 0.49

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
SCHEMBL18302044 1.00 LTA4H (0.60) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL318324 0.88 PLA2G2A (0.49) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL17241411 0.87 LTA4H (0.64) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL17247317 0.87 LTA4H (0.64) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL17241274 0.87 LTA4H (0.64) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL17241354 0.85 LTA4H (0.66) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL18302086 0.84 LTA4H (0.60) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL9304869 0.84 LTA4H (0.60) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL533827 0.84 LTA4H (0.60) LTA4HNR5A1TP53TSHRPLA2G4B
SCHEMBL2436449 0.84 LTA4H (0.60) LTA4HNR5A1TP53TSHRPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5319079-A Reacting the 5'-hydroxyl group of a nucleoside-terminated supported oligonucleotide with a trityl or pixyl halide using an anhydrous solvent, a electronegative reagent and a trialkylamine BECKMAN INSTRUMENTS, INC. (US) 1994-06-07 US disclosed