SCHEMBL9154048

SCHEMBL9154048

CCN(CC)C(=O)CC(c1ccccc1)c1cccc(C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.58
GLA P06280 1/20 0.58
RECQL P46063 1/20 0.58
NPSR1 Q6W5P4 4/20 0.54
KMT2A Q03164 3/20 0.54
HTT P42858 2/20 0.54
MEN1 O00255 2/20 0.54
ALDH1A1 P00352 2/20 0.54
GAA P10253 2/20 0.54
TDP1 Q9NUW8 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 2/20 0.47
LTB4R Q15722 1/20 0.47
LTB4R2 Q9NPC1 1/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
HCRTR2 O43614 1/20 0.45
BRD4 O60885 1/20 0.45
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL11385152 0.87 HPGD (0.71) HPGDGLARECQLNPSR1KMT2A
SCHEMBL27399561 0.82 HPGD (0.54) HPGDGLARECQLNPSR1KMT2A
SCHEMBL9152199 0.81 CTSA (0.52) NPSR1KMT2AMEN1ALDH1A1GAA
SCHEMBL5685200 0.81 HPGD (0.57) HPGDGLARECQLNPSR1KMT2A
SCHEMBL30530340 0.74 TRPM8 (0.68) HPGDGLARECQLNPSR1KMT2A
SCHEMBL3637064 0.73 ACP3 (0.49) NPSR1HTTGAATDP1MAPT
SCHEMBL9413681 0.72 BRD4 (0.44) HPGDNPSR1KMT2AMEN1ALDH1A1
M-Xylene SCHEMBL29227733 0.72 HPGD (0.62) HPGDKMT2AHTTMEN1ALDH1A1
SCHEMBL8921884 0.72 ACP3 (0.49) HTTGAAMAPTBRD4LMNA
SCHEMBL12158735 0.72 MGAM (0.58) HPGDNPSR1KMT2AHTTMEN1

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
US-5414008-A Hypotensive and antiatherosclerotic agents BAYER AKTIENGESELLSCHAFT (DE) 1995-05-09 US disclosed
EP-0578002-A1 Imidazolyl substituted phenylpropionic and cinnamic acid derivatives BAYER AG (DE) 1994-01-12 EP disclosed