SCHEMBL750094

SCHEMBL750094

CC(O)CCCC1COC(c2ccccc2)(C(O)c2ccccc2)O1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 9/20 0.34
HTR1A P08908 8/20 0.34
ADRA1D P25100 8/20 0.34
ADRA1B P35368 8/20 0.34
ALOX15 P16050 1/20 0.31
OPRL1 P41146 2/20 0.31
OPRM1 P35372 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL751244 0.88 ALDH1A1 (0.33) ADRA1AHTR1AADRA1DADRA1B
SCHEMBL749059 0.88 HTR1A (0.33) ADRA1AHTR1AADRA1DADRA1BOPRL1
SCHEMBL748893 0.88 OPRM1 (0.35) ADRA1AHTR1AADRA1DADRA1BOPRL1
Methyl Alcohol SCHEMBL749595 0.87 HTR1A (0.32) ADRA1AHTR1AADRA1DADRA1BOPRL1
SCHEMBL750087 0.87 OPRM1 (0.36) ADRA1AHTR1AADRA1DADRA1BOPRL1
SCHEMBL750056 0.86 HTR1A (0.35) ADRA1AHTR1AADRA1DADRA1BCHRM2
Methyl Alcohol SCHEMBL3692825 0.86 HTR1A (0.34) ADRA1AHTR1AADRA1DADRA1BOPRL1
SCHEMBL747690 0.86 OPRM1 (0.37) ADRA1AHTR1AADRA1DADRA1BOPRL1
SCHEMBL748890 0.85 HTR1A (0.35) ADRA1AHTR1AADRA1DADRA1BOPRL1
SCHEMBL749051 0.85 HTR1A (0.36) ADRA1AHTR1AADRA1DADRA1BCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2452984-A1 Degassing Compositions for Curable Coatings Troy Technology Corporation, Inc. (US) 2012-05-16 EP claimed
EP-2152812-B1 DEGASSING COMPOSITIONS FOR CURABLE COATINGS TROY TECHNOLOGY CORP INC (US) 2012-03-21 EP claimed
US-7615585-B2 Degassing compositions for curable coatings TROY CORPORATION (US) 2009-11-10 US claimed
US-20090023847-A1 Degassing compositions for curable coatings TROY CORPORATION 2009-01-22 US claimed
EP-2452984-A1 Degassing Compositions for Curable Coatings Troy Technology Corporation, Inc. (US) 2012-05-16 EP disclosed
EP-2152812-B1 DEGASSING COMPOSITIONS FOR CURABLE COATINGS TROY TECHNOLOGY CORP INC (US) 2012-03-21 EP disclosed
US-7842745-B2 Degassing compositions for curable coatings TROY CORPORATION (US) 2010-11-30 US disclosed
US-20100204373-A1 Degassing compositions for curable coatings TROY CORPORATION 2010-08-12 US disclosed
US-7615585-B2 Degassing compositions for curable coatings TROY CORPORATION (US) 2009-11-10 US disclosed
US-20090023847-A1 Degassing compositions for curable coatings TROY CORPORATION 2009-01-22 US disclosed