SCHEMBL5035686

SCHEMBL5035686

CC(=O)c1cc(OCc2ccccc2)cc(C(C)=O)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.59
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
P4HTM Q9NXG6 1/20 0.53
NR4A2 P43354 2/20 0.50
MCL1 Q07820 2/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NR4A1 P22736 1/20 0.50
NR4A3 Q92570 1/20 0.50
ALOX5 P09917 3/20 0.49
PTGS1 P23219 2/20 0.49
PTGS2 P35354 2/20 0.49
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
PARP10 Q53GL7 1/20 0.47

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
SCHEMBL31543383 0.91 MAOB (0.54) MAOBMEN1KMT2AP4HTMNR4A2
SCHEMBL5905664 0.91 MAOB (0.54) MAOBMEN1KMT2AP4HTMNR4A2
SCHEMBL26874933 0.90 MAOB (0.52) MAOBMEN1KMT2AP4HTMNR4A2
SCHEMBL15892266 0.89 MEN1 (0.55) MAOBMEN1KMT2AALDH1A1L3MBTL1
SCHEMBL14278777 0.87 MEN1 (0.65) MAOBMEN1KMT2AP4HTMNR4A2
SCHEMBL9658088 0.85 MEN1 (0.63) MAOBMEN1KMT2AP4HTMNR4A2
SCHEMBL3534571 0.84 LMNA (0.55) MAOBMEN1KMT2AP4HTMNR4A2
SCHEMBL14278335 0.84 MEN1 (0.57) MAOBMEN1KMT2AP4HTMNR4A2
SCHEMBL9656705 0.83 MEN1 (0.55) MAOBMEN1KMT2AP4HTMNR4A2
SCHEMBL112672 0.82 MEN1 (0.59) MAOBMEN1KMT2AALDH1A1L3MBTL1

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
WO-2008034911-A1 NEW BIO-COMPATIBLE POLYMER MATERIALS, METHOD FOR PRODUCING THE SAME AND USES THEREOF, PARTICULARLY IN MEDICAL MAGNETIC-RESONANCE IMAGING BIOSPHERE MEDICAL (FR) 2008-03-27 WO disclosed
WO-2008034911-A1 NEW BIO-COMPATIBLE POLYMER MATERIALS, METHOD FOR PRODUCING THE SAME AND USES THEREOF, PARTICULARLY IN MEDICAL MAGNETIC-RESONANCE IMAGING BIOSPHERE MEDICAL (FR) 2008-03-27 WO disclosed