SCHEMBL24036799

SCHEMBL24036799

c1ccc(-c2ccc(-c3nc4ccccc4nc3-n3c4ccccc4c4cc(-c5ccccc5)ccc43)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.43
CASP1 P29466 1/20 0.43
HRH4 Q9H3N8 1/20 0.43
NPY5R Q15761 1/20 0.42
DHODH Q02127 2/20 0.42
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 4/20 0.41
GAA P10253 2/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
TSPO P30536 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HTT P42858 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL20232275 0.96 HSD17B10 (0.43) HSD17B10CASP1HRH4NPY5RDHODH
SCHEMBL22479858 0.95 KDM4E (0.45) HSD17B10CASP1HRH4NPY5RDHODH
SCHEMBL18775319 0.95 KDM4E (0.45) HSD17B10CASP1HRH4NPY5RDHODH
SCHEMBL20348048 0.95 KDM4E (0.41) HSD17B10CASP1HRH4NPY5RDHODH
SCHEMBL17253791 0.95 KDM4E (0.45) HSD17B10CASP1HRH4NPY5RDHODH
SCHEMBL21709120 0.95 KDM4E (0.41) HSD17B10CASP1HRH4NPY5RDHODH
SCHEMBL20348055 0.94 HSD17B10 (0.39) HSD17B10CASP1HRH4NPY5RDHODH
SCHEMBL18505341 0.93 KDM4E (0.46) HSD17B10CASP1HRH4NPY5RDHODH
SCHEMBL24104201 0.93 HSD17B10 (0.48) HSD17B10CASP1HRH4DHODHKDM4E
SCHEMBL24596556 0.93 KDM4E (0.40) HSD17B10CASP1HRH4NPY5RDHODH

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
WO-2021230651-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-11-18 WO disclosed