SCHEMBL13680939

SCHEMBL13680939

CNC(=O)Oc1ccc(-c2nc(CCC=O)cs2)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
LMNA P02545 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
TP53 P04637 9/20 0.44
THRB P10828 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.44
POLB P06746 1/20 0.42
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL13680957 0.87 KDM4E (0.50) MAPTLMNASMN1; SMN2L3MBTL1KDM4E
SCHEMBL13680942 0.84 KDM4E (0.47) MAPTLMNASMN1; SMN2L3MBTL1KDM4E
SCHEMBL13680941 0.84 KDM4E (0.47) MAPTLMNASMN1; SMN2L3MBTL1KDM4E
SCHEMBL13680951 0.82 MAPT (0.55) MAPTLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL13680929 0.81 ALDH1A1 (0.62) MAPTLMNASMN1; SMN2L3MBTL1KDM4E
SCHEMBL13680936 0.80 TP53 (0.46) MAPTLMNATP53HTTPOLB
SCHEMBL13680934 0.80 TP53 (0.51) MAPTLMNASMN1; SMN2L3MBTL1KDM4E
SCHEMBL13680958 0.80 RXFP1 (0.57) MAPTLMNASMN1; SMN2L3MBTL1KDM4E
SCHEMBL13681040 0.79 MAPT (0.43) MAPTLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL13680932 0.78 KMT2A (0.47) MAPTLMNASMN1; SMN2KDM4EALDH1A1

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
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed