SCHEMBL11266077

SCHEMBL11266077

CCCCN1C(=O)C(Cc2ccccc2)N(C)C1=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 4/20 0.55
MMP1 P03956 1/20 0.51
MMP3 P08254 1/20 0.51
MMP9 P14780 1/20 0.51
GFER P55789 1/20 0.44
CAPN1 P07384 1/20 0.43
EP300 Q09472 1/20 0.42
CNR2 P34972 3/20 0.41
CNR1 P21554 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TACR1 P25103 1/20 0.40

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
SCHEMBL11267531 0.83 MMP1 (0.56) HDAC6MMP1MMP3MMP9CNR2
SCHEMBL11264078 0.83 HDAC6 (0.74) HDAC6EP300GSK3AGSK3B
SCHEMBL11269906 0.82 MMP1 (0.54) HDAC6MMP1MMP3MMP9CNR2
SCHEMBL11266702 0.80 MMP1 (0.47) HDAC6MMP1MMP3MMP9EP300
SCHEMBL11270800 0.78 HDAC6 (0.52) HDAC6MMP1MMP3MMP9GFER
SCHEMBL23873935 0.77 CAPN1 (0.67) HDAC6MMP1MMP3MMP9GFER
SCHEMBL25937447 0.77 CAPN1 (0.67) HDAC6MMP1MMP3MMP9GFER
SCHEMBL20516454 0.75 HDAC6 (0.53) HDAC6MMP1MMP3MMP9GFER
SCHEMBL20516455 0.75 HDAC6 (0.53) HDAC6MMP1MMP3MMP9GFER
SCHEMBL11259949 0.74 HDAC6 (0.62) HDAC6MMP1MMP3MMP9EP300

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0005647-B1 HYDANTOIN COMPOUNDS, THEIR PREPARATION AND PHARMACEUTICAL FORMULATIONS CONTAINING THEM Lilly Industries Limited (GB) 1982-06-09 EP disclosed
US-4293563-A ANTIASTHMATICS LILLY INDUSTRIES LIMITED (GB) 1981-10-06 US disclosed
US-4241073-A ASTHMA LILLY INDUSTRIES LIMITED (GB) 1980-12-23 US disclosed
EP-0005647-A1 Hydantoin compounds, their preparation and pharmaceutical formulations containing them Lilly Industries Limited (GB) 1979-11-28 EP disclosed