SCHEMBL10709355

SCHEMBL10709355

CCOC(=O)CCOCCN1C=NCC1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
TSHR P16473 3/20 0.35
POLB P06746 1/20 0.35
ALDH1A1 P00352 3/20 0.35
RAB9A P51151 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CHRM1 P11229 1/20 0.33
NOTUM Q6P988 1/20 0.33
CYP1A2 P05177 1/20 0.33
KAT2B Q92831 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
HRH1 P35367 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
TNF P01375 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL11609810 0.87 ALDH1A1 (0.40) LMNATSHRPOLBALDH1A1RAB9A
SCHEMBL30324420 0.77 DGKA (0.53) LMNATSHRALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL30324322 0.76 DGKA (0.51) LMNATSHRALDH1A1L3MBTL1MEN1
SCHEMBL10709347 0.75 TSHR (0.31) LMNATSHRALDH1A1RAB9AKMT2A
Sulfuric Acid SCHEMBL30324480 0.73 DGKA (0.48) LMNATSHRALDH1A1L3MBTL1MEN1
SCHEMBL6817948 0.73 GAA (0.55) LMNATSHRPOLBALDH1A1L3MBTL1
SCHEMBL10709362 0.71 TSHR (0.35) LMNATSHRPOLBALDH1A1RAB9A
SCHEMBL11609568 0.71 SMN1; SMN2 (0.41) LMNATSHRALDH1A1NOTUMKAT2B
SCHEMBL13754179 0.71 GAA (0.52) LMNATSHRPOLBALDH1A1L3MBTL1
SCHEMBL1727365 0.71 GAA (0.52) LMNATSHRPOLBALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0275907-A2 Rim polyurethane or polyurea compositions containing internal mold release agents MOBAY CORPORATION (US) 1988-07-27 EP disclosed