SCHEMBL1472489

SCHEMBL1472489

CC(C)(CO)CO.CC(CCO)CCO

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 1/20 0.44
DPP4 P27487 1/20 0.38
TRPA1 O75762 1/20 0.34
TSHR P16473 1/20 0.32

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
SCHEMBL16752544 0.85 ALDH1A1 (0.34) ALDH1A1ALOX15DPP4TRPA1
SCHEMBL16752545 0.85 ALDH1A1 (0.34) ALDH1A1ALOX15DPP4TRPA1
SCHEMBL147380 0.84 ALDH1A1 (0.37) ALDH1A1ALOX15DPP4TRPA1
SCHEMBL28762 0.82
1,3-Butanediol SCHEMBL8193782 0.81 TDP1 (0.38) ALDH1A1DPP4TSHR
SCHEMBL11059751 0.78 ALDH1A1 (0.55) ALDH1A1ALOX15DPP4TRPA1TSHR
Ethylene Glycol SCHEMBL5930511 0.78 ALDH1A1 (0.55) ALDH1A1ALOX15DPP4TRPA1TSHR
1,6-Hexanediol SCHEMBL9247725 0.77 ALDH1A1 (0.32) ALDH1A1ALOX15DPP4TSHR
SCHEMBL3189647 0.77 TSHR (0.41) TRPA1TSHR
SCHEMBL20191265 0.76 ALDH1A1 (0.43) ALDH1A1ALOX15DPP4TRPA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9358810-B2 Inkjet recording method and inkjet recorder RICOH COMPANY, LTD. (JP) 2016-06-07 US disclosed
US-20150165787-A1 INKJET RECORDING METHOD AND INKJET RECORDER RICOH COMPANY, LTD. (JP) 2015-06-18 US disclosed
US-7915373-B2 Golf ball SRI SPORTS LIMITED (JP) 2011-03-29 US disclosed
US-20080161136-A1 Golf ball SRI SPORTS LIMITED 2008-07-03 US disclosed