SCHEMBL28045646

SCHEMBL28045646

CCNc1cccc(NC(C)=O)c1OC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.47
▸ MAPK1 P28482 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ IDO1 P14902 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MAPK8 P45983 1/20 0.41
▸ BRD4 O60885 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ ADORA2B P29275 1/20 0.39

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
SCHEMBL19383916 0.79 MAPK1 (0.62) TSHRMAPK1ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL6774791 0.78 BRD4 (0.55) TSHRMAPK1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL14046286 0.78 ALDH1A1 (0.61) TSHRMAPK1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL15670749 0.77 GAA (0.51) TSHRMAPK1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL5380234 0.77 CASR (0.53) MAPK1ALDH1A1SMN1; SMN2KDM4EHTT
SCHEMBL9350593 0.77 HSD17B10 (0.47) TSHRMAPK1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL8374069 0.77 KDM4E (0.46) TSHRMAPK1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL15535856 0.75 KDM4E (0.45) TSHRMAPK1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL13255390 0.75 LMNA (0.51) TSHRMAPK1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL11745271 0.75 CTSD (0.51) MAPK1ALDH1A1SMN1; SMN2KDM4EHPGD

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
CN-103709787-B Synthesis method of azo type disperse dye composition ZHEJIANG JIHUA GROUP CO.,LTD. (CN) 2015-12-23 — — CN disclosed
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