SCHEMBL5227447

SCHEMBL5227447

CC(=O)On1c(-c2ccccc2)cc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
HPGD P15428 1/20 0.56
HSD17B10 Q99714 1/20 0.56
KMT2A Q03164 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MTNR1A P48039 2/20 0.45
MTNR1B P49286 2/20 0.45
NR1H2 P55055 4/20 0.43
NR1H3 Q13133 2/20 0.43
MAOA P21397 3/20 0.42
MAOB P27338 2/20 0.42
MCL1 Q07820 1/20 0.41
HAO1 Q9UJM8 1/20 0.41
PDGFRB P09619 1/20 0.40
KDR P35968 1/20 0.40
DAO P14920 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
SCHEMBL5201047 0.83 L3MBTL1 (0.50) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL6142952 0.81 HPGD (0.57) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL5201509 0.79 TP53 (0.47) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL28853394 0.79 DAO (0.41) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL11747741 0.78 KMT2A (0.59) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL6471856 0.76 MCL1 (0.39) ALDH1A1KDM4EHPGDHSD17B10MAOA
SCHEMBL13940630 0.76 ALDH1A1 (0.60) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL28907783 0.75 HDAC10 (0.43) ALDH1A1KDM4EHPGDHSD17B10NR1H2
SCHEMBL11745418 0.74 KMT2A (0.54) ALDH1A1KDM4EHPGDHSD17B10KMT2A
SCHEMBL11558606 0.74 ALDH1A1 (0.51) ALDH1A1KDM4EHPGDHSD17B10KMT2A

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
EP-1829872-B1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS NISSAN CHEMICAL IND LTD (JP) 2015-07-29 EP disclosed
EP-1829872-A1 PROCESSES FOR PRODUCTION OF INDOLE COMPOUNDS Nissan Chemical Industries, Ltd. (JP) 2007-09-05 EP disclosed