SCHEMBL3923290

SCHEMBL3923290

CN(C)CCOCCOCCN(C)CCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
ALDH1A1 P00352 4/20 0.49
MAPT P10636 1/20 0.48
KDM4E B2RXH2 5/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CA12 O43570 3/20 0.47
CA2 P00918 3/20 0.47
CA9 Q16790 3/20 0.47
CA1 P00915 2/20 0.47
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
CHRM2 P08172 1/20 0.35

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
SCHEMBL235061 0.98 MAPT (0.50) LMNAALDH1A1MAPTKDM4EMEN1
Ammonia Solution, Strong SCHEMBL28289433 0.95 MAPT (0.48) LMNAALDH1A1MAPTKDM4EMEN1
SCHEMBL18572064 0.91 LMNA (0.51) LMNAALDH1A1MAPTKDM4EMEN1
SCHEMBL8324832 0.86 TSHR (0.50) LMNAALDH1A1MAPTKDM4EMEN1
SCHEMBL769551 0.85 CA12 (0.50) LMNAALDH1A1MAPTCA12CA2
SCHEMBL14029335 0.85 LMNA (0.43) LMNAALDH1A1MAPTKDM4EMEN1
SCHEMBL8591158 0.84 CA12 (0.41) LMNAALDH1A1MAPTKDM4EMEN1
SCHEMBL23509359 0.84 ALDH1A1 (0.51) LMNAALDH1A1MAPTKDM4EMEN1
SCHEMBL14029328 0.84 MEN1 (0.48) LMNAALDH1A1MAPTKDM4EMEN1
SCHEMBL20084554 0.84 LMNA (0.47) LMNAALDH1A1MAPTKDM4EMEN1

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-7572837-B2 Process for the production of flexible polyurethane foams TOSOH CORPORATION (JP) 2009-08-11 US disclosed
US-20030144371-A1 Catalyzing the copolymerization in presence of imidazole compounds, free of tin comound, forming polyetherurethane copolymers TOSOH CORPORATION (JP) 2003-07-31 US disclosed
EP-1312630-A1 Process for the production of flexible polyurethane foams Tosoh Corporation (JP) 2003-05-21 EP disclosed