SCHEMBL8032386

SCHEMBL8032386

CCCCCCCCCCCC(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.46
LTA4H P09960 2/20 0.46
MLNR O43193 1/20 0.44
NR1I2 O75469 1/20 0.44
ESR1 P03372 1/20 0.44
NR3C1 P04150 1/20 0.44
PGR P06401 1/20 0.44
ADRB2 P07550 1/20 0.44
CHRM2 P08172 1/20 0.44
ADRB1 P08588 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD2 P14416 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
CHRM3 P20309 1/20 0.44
MAOA P21397 1/20 0.44
CNR1 P21554 1/20 0.44

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
SCHEMBL4445054 0.98 LTA4H (0.47) CSNK1ELTA4HMLNRNR1I2ESR1
SCHEMBL4453544 0.92 LTA4H (0.47) CSNK1ELTA4HMLNRNR1I2ESR1
SCHEMBL28001079 0.90 CSNK1E (0.42) CSNK1ELTA4HMLNRNR1I2ESR1
SCHEMBL20710831 0.90 CSNK1E (0.42) CSNK1ELTA4HMLNRNR1I2ESR1
SCHEMBL28358745 0.90 CSNK1E (0.42) CSNK1ELTA4HMLNRNR1I2ESR1
SCHEMBL10389318 0.87 PPARA (0.41) CSNK1ELTA4HCNR1CNR2EPHX2
SCHEMBL11664231 0.85 CSNK1E (0.46) CSNK1ELTA4HMLNRNR1I2ESR1
SCHEMBL7995558 0.85 LTA4H (0.46) CSNK1ELTA4HMLNRNR1I2ESR1
SCHEMBL6547814 0.85 LTA4H (0.46) CSNK1ELTA4HMLNRNR1I2ESR1
SCHEMBL18430836 0.85 LTA4H (0.46) CSNK1ELTA4HMLNRNR1I2ESR1

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
EP-0981590-A1 PHOTOINITIATORS AND OXYGEN SCAVENGING COMPOSITIONS Chevron Chemical Company LLC (US) 2000-03-01 EP disclosed
WO-1998051758-A1 PHOTOINITIATORS AND OXYGEN SCAVENGING COMPOSITIONS CHEVRON CHEMICAL COMPANY LLC (US) 1998-11-19 WO disclosed