SCHEMBL9699277

SCHEMBL9699277

CC1(COCCN2CCOCC2)COC(c2nc(-c3ccccc3)c(-c3ccccc3)n2Cc2ccccc2)OC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 9/20 0.48
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TLR7 Q9NYK1 1/20 0.37
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL9736515 0.88 SOAT1 (0.40) SOAT1HSD17B10KDM4EALDH1A1HPGD
SCHEMBL9698693 0.86 SOAT1 (0.49) SOAT1
SCHEMBL9699234 0.83 SOAT1 (0.43) SOAT1MEN1KMT2AL3MBTL1NPC1
SCHEMBL9738043 0.82 SOAT1 (0.48) SOAT1ALDH1A1TSHR
SCHEMBL9852391 0.82 SOAT1 (0.42) SOAT1ALDH1A1HPGDNPSR1
SCHEMBL9700239 0.82 SOAT1 (0.47) SOAT1ALDH1A1TSHR
SCHEMBL9700086 0.82 SOAT1 (0.47) SOAT1ALDH1A1TSHR
SCHEMBL9698751 0.81 SOAT1 (0.50) SOAT1HSD17B10KDM4EALDH1A1HPGD
SCHEMBL9698703 0.80 SOAT1 (0.49) SOAT1
SCHEMBL9698127 0.79 SOAT1 (0.64) SOAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992017470-A1 IMIDAZOLES RHONE-POULENC RORER LIMITED (GB) 1992-10-15 WO disclosed
EP-0506437-A1 Imidazoles RHONE POULENC RORER LIMITED (GB) 1992-09-30 EP disclosed