SCHEMBL749307

SCHEMBL749307

OCCCCC1COC(c2ccccc2)(c2ccccc2CO)O1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 15/20 0.41
HTR1A P08908 13/20 0.41
ADRA1D P25100 12/20 0.41
ADRA1B P35368 12/20 0.41
GAA P10253 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL4323822 0.96 ADRA1A (0.42) ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL3412898 0.91 ADRA1A (0.43) ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL750523 0.91 ADRA1A (0.41) ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL748991 0.90 ADRA1A (0.41) ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL752340 0.89 ADRA1A (0.42) ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL751251 0.88 HTR1A (0.39) ADRA1AHTR1AADRA1DADRA1B
SCHEMBL749621 0.86 ADRA1A (0.42) ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL748670 0.86 HTR1A (0.43) ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL750093 0.85 ADRA1A (0.39) ADRA1AHTR1AADRA1DADRA1BGAA
SCHEMBL749991 0.85 ADRA1A (0.43) ADRA1AHTR1AADRA1DADRA1BGAA

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-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