SCHEMBL5068756

SCHEMBL5068756

C=CCOC(=O)C1C2C=CC(C2)C1C(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 1/20 0.43
HTT P42858 2/20 0.41
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP19A1 P11511 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
ERN1 O75460 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 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
SCHEMBL14493389 0.92 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL7755420 0.92 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL5070821 0.88 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL990584 0.86 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL16022156 0.81 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL16022155 0.81 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL16022154 0.81 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL17277155 0.81 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL5732376 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTLMNA
SCHEMBL14827588 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1655321-B1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME ZEON CORP (JP) 2012-11-21 EP disclosed
US-7381782-B2 Polymerizable composition and molded articles produced by using the same ZEON CORPORATION (JP) 2008-06-03 US disclosed
US-20060258828-A1 Polymerizable composition and molded articles produced by using the same ZEON CORPORATION (JP) 2006-11-16 US disclosed
EP-1655321-A1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME Zeon Corporation (JP) 2006-05-10 EP disclosed