SCHEMBL9394792

SCHEMBL9394792

CCCCCCCCCCCCCCCCOc1ccccc1OCCCCCCCCCCCCCCCC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
MEN1 O00255 1/20 0.62
NR1I2 O75469 1/20 0.62
CHRM2 P08172 1/20 0.62
CYP3A4 P08684 1/20 0.62
ADRA2A P08913 1/20 0.62
MAPT P10636 1/20 0.62
OPRK1 P41145 1/20 0.62
HTR2B P41595 1/20 0.62
SLC6A3 Q01959 1/20 0.62
KMT2A Q03164 1/20 0.62
HDAC6 Q9UBN7 1/20 0.62
CYP1A2 P05177 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
L3MBTL1 Q9Y468 3/20 0.57
ALDH1A1 P00352 3/20 0.55
LTA4H P09960 1/20 0.53
MCHR1 Q99705 2/20 0.53
TLR8 Q9NR97 2/20 0.53

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
SCHEMBL8974126 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL30620186 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL30292285 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL29868324 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL9387360 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL1778134 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL1964196 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL2245919 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL2859001 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4
SCHEMBL28106102 1.00 LMNA (0.62) LMNAMEN1NR1I2CHRM2CYP3A4

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
WO-1994029243-A1 SYNTHESIS OF SUBSTITUTED TRIPHENYLENES, USEFUL AS DISCOTIC LIQUID CRYSTALS BRITISH TECHNOLOGY GROUP LIMITED (GB) 1994-12-22 WO disclosed