SCHEMBL3153385

SCHEMBL3153385

CC(O)OCCNCCOC(C)O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HTT P42858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTR1A P08908 1/20 0.30
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30
ADRA1B P35368 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
SCHEMBL1548914 0.89 CA12 (0.43) MEN1KMT2AALDH1A1
SCHEMBL7286654 0.87
SCHEMBL1720225 0.87
SCHEMBL1052166 0.87 TSHR (0.42) KMT2AALDH1A1
SCHEMBL1440126 0.83 ALDH1A1 (0.50) ALDH1A1
SCHEMBL8225746 0.83 KDM4E (0.36) MEN1KMT2AALDH1A1
SCHEMBL22609583 0.81
SCHEMBL5611395 0.81
SCHEMBL9872516 0.79 HTR1B (0.34) MEN1KMT2A
SCHEMBL8068207 0.78 ALDH1A1 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1935912-B1 Method for manufacturing PIPA-polyols in order to manufacture high-elasticity polyurethane soft foam material BAYER MATERIALSCIENCE AG (DE) 2010-03-17 EP disclosed
US-20080167394-A1 Process for the preparation of PIPA polyols for the production of highly elastic flexible polyurethane foams BAYER MATERIALSCIENCE AG 2008-07-10 US disclosed
EP-1935912-A1 Method for manufacturing PIPA-polyols in order to manufacture high-elasticity polyurethane soft foam material Bayer MaterialScience AG (DE) 2008-06-25 EP disclosed
EP-0884338-B1 Process for production of high resilient polyurethane foam BAYER AG (DE) 2002-10-02 EP disclosed
US-5977198-A Process for the production of resilient, flexible polyurethane foams BAYER AKTIENGESELLSCHAFT (DE) 1999-11-02 US disclosed
EP-0884338-A1 Process for production of high resilient polyurethane foam BAYER AG (DE) 1998-12-16 EP disclosed
EP-0411400-B1 Basic condensates BAYER AG (DE) 1994-11-30 EP disclosed
EP-0411400-A2 Basic condensates BAYER AG (DE) 1991-02-06 EP disclosed