SCHEMBL14669263

SCHEMBL14669263

CC(O)CN(CC(C)O)CC(C)(C)N(CC(C)O)CC(C)O

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.30
RECQL P46063 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL9857947 0.78 KDM4E (0.34) KDM4ETSHRRECQLMAPK1
SCHEMBL20808596 0.76 ALDH1A1 (0.38) TSHRMAPK1
SCHEMBL6765929 0.76 TSHR (0.36) TSHRMAPK1
SCHEMBL14663278 0.76 ALDH1A1 (0.38) TSHRMAPK1
SCHEMBL15512197 0.74 KDM4E (0.32) KDM4ETSHRRECQLMAPK1
Ammonia Solution, Strong SCHEMBL21408700 0.74 TSHR (0.35) TSHRMAPK1
SCHEMBL3971771 0.74 ALDH1A1 (0.32)
SCHEMBL925732 0.72 MAPK1 (0.36) TSHRMAPK1
SCHEMBL7099123 0.71 TSHR (0.44) KDM4ETSHRRECQLMAPK1
SCHEMBL28985 0.71 TSHR (0.44) KDM4ETSHRRECQLMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140235776-A1 AMINOALCOHOL COMPOUNDS AND THEIR USE AS ZERO OR LOW VOC ADDITIVES FOR PAINTS AND COATINGS ANGUS CHEMICAL COMPANY (US) 2014-08-21 US disclosed
US-20140235776-A1 AMINOALCOHOL COMPOUNDS AND THEIR USE AS ZERO OR LOW VOC ADDITIVES FOR PAINTS AND COATINGS ANGUS CHEMICAL COMPANY (US) 2014-08-21 US disclosed
WO-2013016269-A1 AMINOALCOHOL COMPOUNDS AND THEIR USE AS ZERO OR LOW VOC ADDITIVES FOR PAINTS AND COATINGS ANGUS CHEMICAL COMPANY (US) 2013-01-31 WO disclosed