SCHEMBL5508063

SCHEMBL5508063

CCOc1ccc(C2(C(N)=O)CCC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
MEN1 O00255 1/20 0.55
TSHR P16473 1/20 0.55
PARP10 Q53GL7 1/20 0.51
TET3 O43151 1/20 0.49
FBXL19 Q6PCT2 1/20 0.49
CXXC5 Q7LFL8 1/20 0.49
TET1 Q8NFU7 1/20 0.49
KDM2B Q8NHM5 1/20 0.49
CXXC4 Q9H2H0 1/20 0.49
KDM2A Q9Y2K7 1/20 0.49
LMNA P02545 1/20 0.49
ALDH1A1 P00352 2/20 0.47
SLC6A2 P23975 5/20 0.47
SLC6A4 P31645 5/20 0.47
SLC6A3 Q01959 5/20 0.47
GAA P10253 1/20 0.44
CYP2C19 P33261 1/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL5510283 0.95 KMT2A (0.57) KMT2AMEN1TSHRPARP10TET3
SCHEMBL11232365 0.86 KMT2A (0.73) KMT2AMEN1TSHRPARP10TET3
SCHEMBL10002472 0.82 LMNA (0.60) KMT2AMEN1TSHRPARP10TET3
SCHEMBL4812653 0.81 KMT2A (0.76) KMT2AMEN1TSHRPARP10TET3
SCHEMBL7706230 0.81 LMNA (0.56) KMT2AMEN1TSHRPARP10LMNA
SCHEMBL4812962 0.80 KMT2A (0.57) KMT2AMEN1TSHRPARP10TET3
SCHEMBL5205623 0.79 LMNA (0.65) KMT2AMEN1TSHRPARP10TET3
SCHEMBL4342214 0.79 KMT2A (0.68) KMT2AMEN1TSHRPARP10TET3
SCHEMBL2112323 0.78 LMNA (0.68) KMT2AMEN1TSHRPARP10LMNA
SCHEMBL14161396 0.76 LMNA (0.53) KMT2AMEN1LMNAALDH1A1HPGD

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
EP-1814866-A2 GONADOTROPIN RELEASING HORMONE RECEPTOR ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2007-08-08 EP claimed
WO-2006058012-A2 GONADOTROPIN RELEASING HORMONE RECEPTOR ANTAGONISTS WYETH (US) 2006-06-01 WO claimed