SCHEMBL2391799

SCHEMBL2391799

CCCCCCCCCC(O)(CCCCCCCCC)COc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.49
MLNR O43193 1/20 0.46
NR1I2 O75469 1/20 0.46
ESR1 P03372 1/20 0.46
NR3C1 P04150 1/20 0.46
PGR P06401 1/20 0.46
ADRB2 P07550 1/20 0.46
CHRM2 P08172 1/20 0.46
ADRB1 P08588 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
CHRM1 P11229 1/20 0.46
DRD2 P14416 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
CHRM3 P20309 1/20 0.46
MAOA P21397 1/20 0.46
CNR1 P21554 1/20 0.46
SLC6A2 P23975 1/20 0.46

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
SCHEMBL11065579 1.00 LTA4H (0.49) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL1527668 0.98 LTA4H (0.50) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL28456626 0.85 LTA4H (0.46) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL5596308 0.85 ALDH1A1 (0.46) LTA4HCHRM2CHRM1CHRM3ALDH1A1
SCHEMBL8851808 0.83 LTA4H (0.57) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL28479045 0.81 ALDH1A1 (0.52) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL27785423 0.77 LTA4H (0.68) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL27321166 0.77 LTA4H (0.68) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL7019687 0.77 LTA4H (0.43) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL11870614 0.76 LTA4H (0.57) LTA4HMLNRNR1I2ESR1NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013092-B1 Waterborne coating THE SHERWIN-WILLIAMS COMPANY (US) 2011-09-06 US disclosed
US-6869996-B1 Waterborne coating having improved chemical resistance THE SHERWIN-WILLIAMS COMPANY (US) 2005-03-22 US disclosed
US-20020103278-A1 Waterborne coating composition SHERWIN-WILLIAMS COMPANY, THE 2002-08-01 US disclosed
EP-1141145-A2 CROSSLINKABLE WATERBORNE COATING THE SHERWIN-WILLIAMS COMPANY (US) 2001-10-10 EP disclosed
WO-2000075247-A2 CROSSLINKABLE WATERBORNE COATING THE SHERWIN-WILLIAMS COMPANY (US) 2000-12-14 WO disclosed