SCHEMBL4669256

SCHEMBL4669256

Cc1cc(C(N)=O)ccc1/C=C/C(=O)NCCc1c(C)[nH]c2c(F)ccc(C)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HDAC1 Q13547 2/20 0.34
HDAC4 P56524 2/20 0.34
HDAC3 O15379 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ATM Q13315 1/20 0.33
GAA P10253 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
SCHEMBL4668484 0.89 MEN1 (0.44) MEN1KMT2AHDAC1HDAC4HDAC3
SCHEMBL4016407 0.85 KMT2A (0.46) MEN1KMT2AHDAC1HDAC4HDAC3
SCHEMBL4017528 0.84 MEN1 (0.49) MEN1KMT2AHDAC1HDAC4HDAC3
SCHEMBL4669466 0.84 MEN1 (0.39) MEN1KMT2AHDAC1HDAC4HDAC6
SCHEMBL4669463 0.84 MEN1 (0.39) MEN1KMT2AHDAC1HDAC4HDAC6
SCHEMBL4017359 0.82 MEN1 (0.49) MEN1KMT2AHDAC1HDAC4HDAC3
SCHEMBL13982460 0.82 MEN1 (0.47) MEN1KMT2AHDAC1HDAC4HDAC3
SCHEMBL4752215 0.82 MEN1 (0.43) MEN1KMT2AHDAC1HDAC4HDAC3
SCHEMBL4668502 0.82 MEN1 (0.43) MEN1KMT2AHDAC1HDAC4HDAC3
SCHEMBL4015839 0.82 MEN1 (0.44) MEN1KMT2AHDAC4MAPTMEF2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2003118-A1 Cinnamic acid derivatives as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-12-17 EP claimed
WO-2008152097-A1 CINNAMIC ACID DERIVATIVES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-18 WO disclosed
EP-2003118-A1 Cinnamic acid derivatives as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (DE) 2008-12-17 EP disclosed