SCHEMBL11274497

SCHEMBL11274497

C=CCN1C(=O)N(Cc2ccccc2)C(=O)C1Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 13/20 0.56
EP300 Q09472 2/20 0.54
HDAC1 Q13547 3/20 0.52
HDAC2 Q92769 3/20 0.52
HDAC8 Q9BY41 3/20 0.52
F2 P00734 1/20 0.45
PLG P00747 1/20 0.45
ELANE P08246 1/20 0.45
CTSG P08311 1/20 0.45
CMA1 P23946 1/20 0.45
CTRC Q99895 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
EHMT2 Q96KQ7 1/20 0.43
POLB P06746 1/20 0.42
GAA P10253 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
SCHEMBL11266702 0.83 MMP1 (0.47) HDAC6EP300HDAC1HDAC2HDAC8
SCHEMBL11394505 0.81 POLB (0.53) HDAC6EP300MEN1KMT2APOLB
SCHEMBL11264078 0.75 HDAC6 (0.74) HDAC6EP300HDAC1HDAC2HDAC8
SCHEMBL11259949 0.75 HDAC6 (0.62) HDAC6EP300HDAC1HDAC2HDAC8
SCHEMBL12914631 0.75 HDAC6 (0.43) HDAC6EP300HDAC1HDAC8
SCHEMBL19923714 0.72 HDAC6 (0.55) HDAC6EP300HDAC1HDAC2HDAC8
SCHEMBL17358735 0.72 EP300 (0.66) EP300F2PLGELANECTSG
SCHEMBL19923523 0.71 EP300 (0.56) HDAC6EP300HDAC1HDAC2HDAC8
SCHEMBL19923616 0.71 EP300 (0.56) HDAC6EP300HDAC1HDAC2HDAC8
SCHEMBL15131570 0.71 EP300 (1.00) HDAC6EP300F2PLGELANE

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