SCHEMBL751259

SCHEMBL751259

OCC1(c2ccccc2)OCC(c2ccccc2)O1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
PTGS2 P35354 1/20 0.37
KDM1A O60341 1/20 0.37
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 2/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CHRM2 P08172 2/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33

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
SCHEMBL9458455 0.84 TSHR (0.41) TSHRGRIN1GRIN2ACHRM2CHRM4
SCHEMBL2109364 0.77 HTR1A (0.39)
SCHEMBL11451929 0.76 TSHR (0.37) TSHRKDM1A
Iodide SCHEMBL663030 0.76 HTR1A (0.38)
SCHEMBL15809707 0.73 CYP19A1 (0.38) TSHRGAASMN1; SMN2
SCHEMBL16973469 0.71 TSHR (0.45) TSHRKDM1ACHRM2CHRM4CHRM5
SCHEMBL1876064 0.71 SMN1; SMN2 (0.47) TSHRPTGS2ALDH1A1GAAMAPT
SCHEMBL16377614 0.68 TSHR (0.50) TSHRKDM1A
SCHEMBL6319516 0.68 MAPK1 (0.41) TSHRGAAMAPTRAB9ASMN1; SMN2
SCHEMBL7787343 0.68 TSHR (0.50) TSHRKDM1A

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 6 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 disclosed
EP-2152812-B1 DEGASSING COMPOSITIONS FOR CURABLE COATINGS TROY TECHNOLOGY CORP INC (US) 2012-03-21 EP disclosed
EP-2152812-A1 DEGASSING COMPOSITIONS FOR CURABLE COATINGS Troy Technology Corporation, Inc. (US) 2010-02-17 EP 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
WO-2008130538-A1 DEGASSING COMPOSITIONS FOR CURABLE COATINGS TROY TECHNOLOGY CORPORATION, INC. (US) 2008-10-30 WO disclosed