SCHEMBL6443784

SCHEMBL6443784

CCCCCCCCCCCCCCCCCCOP(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.46
TSHR P16473 4/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP3A4 P08684 3/20 0.41
MAPK1 P28482 2/20 0.41
TP53 P04637 2/20 0.41
NR1I2 O75469 2/20 0.40
CHRM2 P08172 2/20 0.40
ADRA2A P08913 2/20 0.40
OPRK1 P41145 2/20 0.40
HTR2B P41595 2/20 0.40
SLC6A3 Q01959 2/20 0.40
MLNR O43193 1/20 0.40
ESR1 P03372 1/20 0.40
NR3C1 P04150 1/20 0.40
PGR P06401 1/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
HTR1A P08908 1/20 0.40

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
SCHEMBL1726961 1.00 LTA4H (0.46) LTA4HTSHRLMNAALDH1A1CYP3A4
SCHEMBL6441125 1.00 LTA4H (0.46) LTA4HTSHRLMNAALDH1A1CYP3A4
SCHEMBL1726805 1.00 LTA4H (0.46) LTA4HTSHRLMNAALDH1A1CYP3A4
SCHEMBL1727222 1.00 LTA4H (0.46) LTA4HTSHRLMNAALDH1A1CYP3A4
SCHEMBL1725078 1.00 LTA4H (0.46) LTA4HTSHRLMNAALDH1A1CYP3A4
SCHEMBL1726193 0.98 LTA4H (0.47) LTA4HTSHRLMNAALDH1A1CYP3A4
SCHEMBL1726701 0.92 LTA4H (0.47) LTA4HTSHRALDH1A1CYP3A4MAPK1
SCHEMBL2937814 0.85 LTA4H (0.46) LTA4HTSHRLMNAALDH1A1CYP3A4
SCHEMBL21403902 0.85 LTA4H (0.46) LTA4HTSHRLMNAALDH1A1CYP3A4
SCHEMBL2929963 0.85 LTA4H (0.46) LTA4HTSHRLMNAALDH1A1CYP3A4

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
CN-1828383-A Liquid crystal display component POLYPLASTICS CO (JP) 2006-09-06 CN disclosed
US-6956072-B1 Thermoplastic resin composition and molded object thereof POLYPLASTICS CO., LTD. (JP) 2005-10-18 US disclosed