SCHEMBL5520649

SCHEMBL5520649

COC(=O)c1cc(C(=O)OC)cc(N2C(=O)C3C4C=CC(C4)C3C2=O)c1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 2/20 0.54
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
HPGD P15428 1/20 0.51
CYP2C19 P33261 2/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP3A4 P08684 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.48
RAB9A P51151 1/20 0.48
MCL1 Q07820 1/20 0.48

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
SCHEMBL14494483 0.88 SMN1; SMN2 (0.45) SMN1; SMN2TSHRKMT2AMEN1HPGD
SCHEMBL13318217 0.86 ALDH1A1 (0.66) SMN1; SMN2TSHRKMT2AMEN1HPGD
SCHEMBL3194211 0.82 MEN1 (0.53) SMN1; SMN2TSHRKMT2AMEN1CYP2C19
SCHEMBL13038585 0.79 USP2 (0.51) SMN1; SMN2TSHRKMT2AMEN1CYP2C19
SCHEMBL13998010 0.79 MEN1 (0.53) SMN1; SMN2TSHRKMT2AMEN1CYP2C19
SCHEMBL5509559 0.77 POLB (0.61) SMN1; SMN2TSHRKMT2AMEN1HPGD
SCHEMBL5515033 0.77 KMT2A (0.64) SMN1; SMN2TSHRKMT2AMEN1CYP2C19
SCHEMBL12599338 0.75 KMT2A (0.61) TSHRKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL7178769 0.74 ALDH1A1 (0.50) SMN1; SMN2TSHRKMT2AMEN1HPGD
SCHEMBL3190188 0.74 KMT2A (0.57) TSHRKMT2AMEN1CYP2C19ALDH1A1

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
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7230058-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-06-12 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-7157523-B2 Ring-opened polynorbornenes JSR CORPORATION (JP) 2007-01-02 US disclosed
US-20060189771-A1 Ring-opened polynorbornenes JSR CORPORATION (JP) 2006-08-24 US disclosed
US-20060041092-A1 Ring-opened polynorbornenes JSR CORPORATION (JP) 2006-02-23 US disclosed