SCHEMBL4748819

SCHEMBL4748819

Cc1cc(Oc2c(C3CC3)nn(CS(C)(=O)=O)c2CO)cc(C)c1C#N

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.37
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL4904300 0.96 PGR (0.34) PGRKDM4EMEN1ALDH1A1LMNA
SCHEMBL4609481 0.88 PGR (0.39) PGRKDM4EMEN1ALDH1A1LMNA
SCHEMBL4752244 0.88 PGR (0.39) PGR
SCHEMBL4748817 0.87 PGR (0.34) PGR
SCHEMBL4607471 0.87 PGR (0.43) PGRKDM4EMEN1ALDH1A1LMNA
SCHEMBL4748729 0.87 KDM4E (0.32) KDM4EMEN1ALDH1A1LMNAKMT2A
SCHEMBL4621738 0.86 PGR (0.38) PGRKDM4EMEN1ALDH1A1LMNA
SCHEMBL4752246 0.85 PGR (0.38) PGRKDM4EMEN1ALDH1A1LMNA
SCHEMBL4751300 0.85 PGR (0.36) PGRKDM4EMEN1ALDH1A1LMNA
SCHEMBL4748816 0.84 PGR (0.36) PGR

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-2008135824-A1 OXYALKYLPYRAZOLE COMPOUNDS USEFUL IN THERAPY PFIZER LIMITED (GB) 2008-11-13 WO disclosed
WO-2008135824-A1 OXYALKYLPYRAZOLE COMPOUNDS USEFUL IN THERAPY PFIZER LIMITED (GB) 2008-11-13 WO disclosed