SCHEMBL5837306

SCHEMBL5837306

CN(C)COC(=O)C1C2C=CC(C2)C1C(=O)OCN(C)C

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
POLB P06746 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HTT P42858 2/20 0.46
LMNA P02545 1/20 0.42
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 3/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.32
TSHR P16473 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
CASP6 P55212 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GAA P10253 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
SCHEMBL5836314 0.93 ALDH1A1 (0.59) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL5836318 0.93 ALDH1A1 (0.59) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL2140593 0.82 ALDH1A1 (0.46) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL2142156 0.80 ALDH1A1 (0.44) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL9605855 0.79 POLB (0.57) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL19318635 0.79 POLB (0.57) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL10050523 0.79 POLB (0.57) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL1451358 0.79 POLB (0.57) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL2139348 0.78 ALDH1A1 (0.43) ALDH1A1POLBSMN1; SMN2HTTLMNA
SCHEMBL1451666 0.76 POLB (0.54) ALDH1A1POLBSMN1; SMN2HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7037993-B2 Norbornene-based ring-opening polymerization polymer, product of hydrogenation of norbornene-based ring-opening polymerization polymer, and processes for producing these ZEON CORPORATION (JP) 2006-05-02 US disclosed
US-20050148746-A1 Norbornene-based ring-opening polymerization polymer, product of hydrogenation of norbornene-based ring-opening polymerization polymer, and processes for producing these ZEON CORPORATION (JP) 2005-07-07 US disclosed