SCHEMBL6533268

SCHEMBL6533268

Cn1cc(C(=O)NCCO)ccc1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.48
CREBBP Q92793 1/20 0.48
MMP13 P45452 1/20 0.48
HTT P42858 4/20 0.47
HPGD P15428 3/20 0.47
POLB P06746 2/20 0.47
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAP2K2 P36507 1/20 0.44
MAP2K1 Q02750 1/20 0.44
BRD4 O60885 1/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL15224261 0.83 CREBBP (0.50) LMNACREBBPHTTHPGDL3MBTL1
SCHEMBL2896747 0.80 CREBBP (0.52) LMNACREBBPHTTHPGDL3MBTL1
SCHEMBL2736608 0.78 ALDH1A1 (0.59) LMNACREBBPHPGDPOLBBRD4
SCHEMBL13702366 0.78 BRD4 (0.54) LMNACREBBPHTTHPGDL3MBTL1
SCHEMBL6534016 0.77 MAP2K1 (0.47) LMNACREBBPHTTHPGDL3MBTL1
SCHEMBL620074 0.76 POLB (0.66) LMNAMMP13HTTHPGDPOLB
SCHEMBL22479631 0.76 CREBBP (0.52) LMNACREBBPHTTHPGDL3MBTL1
SCHEMBL1309562 0.75 EPHX2 (0.43) HTTHPGDPOLBBRD4KMT2A
SCHEMBL15245139 0.74 BRD4 (0.44) LMNAMMP13HTTHPGDPOLB
SCHEMBL13702157 0.73 CREBBP (0.50) LMNACREBBPHTTHPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005000818-A1 5-SUBSTITUTED-4-`(SUBSTITUTED PHENYL)!AMINO!-2-PYRIDONE DEVIATIVES FOR USE AS MEK INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2005-01-06 WO disclosed