SCHEMBL8265472

SCHEMBL8265472

CC(=O)Nc1ccc(-c2cccc(C)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.66
HTT P42858 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
TDP1 Q9NUW8 1/20 0.58
CNR1 P21554 1/20 0.57
CSF1R P07333 1/20 0.56
FLT1 P17948 1/20 0.56
FLT3 P36888 1/20 0.56
IDO1 P14902 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
KMT2A Q03164 6/20 0.53
MEN1 O00255 5/20 0.53
ALDH1A1 P00352 3/20 0.53
MAPT P10636 3/20 0.53
HPGD P15428 3/20 0.53
RXFP1 Q9HBX9 3/20 0.53
KDM4E B2RXH2 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
CYP2C19 P33261 1/20 0.53

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
SCHEMBL13680541 0.88 HSD17B10 (0.79) HSD17B10SMN1; SMN2CNR1KMT2AMEN1
SCHEMBL8577619 0.86 SMN1; SMN2 (0.70) HSD17B10HTTSMN1; SMN2L3MBTL1CNR1
SCHEMBL13680497 0.85 KIF11 (0.69) CNR1CSF1RFLT1FLT3KMT2A
SCHEMBL13680444 0.83 CNR1 (0.62) SMN1; SMN2CNR1CSF1RFLT1FLT3
SCHEMBL13680466 0.83 FAAH (0.56) SMN1; SMN2CNR1CSF1RFLT1FLT3
SCHEMBL12999591 0.83 NPC1 (0.69) HSD17B10HTTSMN1; SMN2L3MBTL1TDP1
SCHEMBL13680447 0.82 PNPLA2 (0.62) CNR1CSF1RFLT1FLT3KMT2A
SCHEMBL23576901 0.81 HTT (0.63) HSD17B10HTTSMN1; SMN2L3MBTL1CNR1
SCHEMBL9293265 0.81 IDO1 (0.64) HSD17B10HTTSMN1; SMN2L3MBTL1IDO1
SCHEMBL17316953 0.81 HTT (0.63) HSD17B10HTTSMN1; SMN2L3MBTL1CNR1

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 3 patents. 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
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
WO-2006069788-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2006-07-06 WO disclosed