SCHEMBL4403350

SCHEMBL4403350

CCNC(=O)N(CC)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
GAA P10253 3/20 0.43
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
KMT2A Q03164 2/20 0.33
ALOX15 P16050 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
SOAT1 P35610 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 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
SCHEMBL14817327 0.83 ALDH1A1 (0.41) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL4405423 0.80 ALDH1A1 (0.48) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL8279963 0.80 ALDH1A1 (0.48) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL27426652 0.75 ALDH1A1 (0.41) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL10068166 0.74 ALDH1A1 (0.44) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL6682335 0.74 ALDH1A1 (0.44) ALDH1A1GAALMNAMMP1MMP2
SCHEMBL5079020 0.73 MCL1 (0.52) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL11687438 0.72 ALDH1A1 (0.42) ALDH1A1GAAMMP1MMP2MMP3
SCHEMBL12016262 0.72 ALDH1A1 (0.42) ALDH1A1GAAMMP1MMP2MMP3
Hydrochloric Acid SCHEMBL11687442 0.72 ALDH1A1 (0.42) ALDH1A1GAALMNAMMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180079852-A1 POLYISOCYANATE COMPOSITION BASED ON 1,5-PENTAMETHYLENE DIISOCYANATE COVESTRO DEUTSCHLAND (DE) 2018-03-22 US disclosed
WO-2016146574-A1 POLYISOCYANTE COMPOSITION BASED ON 1,5-PENTAMETHYLENE DIISOCYANATE COVESTRO DEUTSCHLAND AG (DE) 2016-09-22 WO disclosed
US-8404348-B2 Resilient, water dispersible polyurethane foams and products incorporating same GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) 2013-03-26 US disclosed
US-20120219780-A1 Resilient, Water Dispersible Polyurethane Foams and Products Incorporating Same GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) 2012-08-30 US disclosed
US-8173718-B2 Resilient, water dispersible polyurethane foams and products incorporating same GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) 2012-05-08 US disclosed
US-8173718-B2 Resilient, water dispersible polyurethane foams and products incorporating same GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) 2012-05-08 US disclosed
WO-2009039083-A1 RESILIENT, WATER DISPERSIBLE POLYURETHANE FOAMS AND PRODUCTS INCORPORATING SAME GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) 2009-03-26 WO disclosed
US-20090075030-A1 Resilient, Water Dispersible Polyurethane Foams and Products Incorporating Same GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) 2009-03-19 US disclosed
US-20090075030-A1 Resilient, Water Dispersible Polyurethane Foams and Products Incorporating Same GEORGIA-PACIFIC CONSUMER PRODUCTS LP (US) 2009-03-19 US disclosed