SCHEMBL8437247

SCHEMBL8437247

CCOC(=O)C=Cc1cccc(CCNC(=O)c2cccc(NC(=O)NCc3ccccc3)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
NAMPT P43490 3/20 0.49
SENP1 Q9P0U3 5/20 0.47
SENP2 Q9HC62 1/20 0.47
MAPT P10636 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.46
THRB P10828 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPK1 P28482 1/20 0.46
ROCK2 O75116 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
PTGS2 P35354 1/20 0.45

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
SCHEMBL7494300 0.93 SENP1 (0.55) LMNANAMPTSENP1SENP2MAPT
SCHEMBL7494303 0.93 SENP1 (0.55) LMNANAMPTSENP1SENP2MAPT
SCHEMBL8428813 0.89 PKM (0.55) LMNANAMPTSENP1SENP2MAPT
SCHEMBL8499211 0.84 LMNA (0.54) LMNANAMPTSENP1MAPTALDH1A1
SCHEMBL8437250 0.84 NAMPT (0.47) LMNANAMPTSENP1SENP2MAPT
SCHEMBL8304013 0.81 KDM4E (0.43) LMNAALDH1A1HTTKDM4EMEN1
SCHEMBL7494961 0.81 SENP1 (0.62) LMNASENP1SENP2ALDH1A1HTT
SCHEMBL7494957 0.81 SENP1 (0.62) LMNASENP1SENP2ALDH1A1HTT
SCHEMBL7861953 0.79 NAMPT (0.55) LMNANAMPTSENP1MAPTALDH1A1
SCHEMBL8500095 0.77 PPARG (0.59) LMNANAMPTSENP1MAPTALDH1A1

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-0894084-A1 CINNAMIC ACID DERIVATIVES AND THEIR USE AS INTEGRIN ANTAGONISTS G.D. SEARLE & CO. (US) 1999-02-03 EP claimed
WO-1997036860-A1 CINNAMIC ACID DERIVATIVES AND THEIR USE AS INTEGRIN ANTAGONISTS G.D. SEARLE & CO. (US) 1997-10-09 WO claimed