SCHEMBL22707259

SCHEMBL22707259

Cc1nc2cccc(-c3c4cccc(-c5cccc6c5-c5ccccc5[Si]6(c5ccccc5)c5ccccc5)c4cc4c(-c5cccc6c5-c5ccccc5[Si]6(c5ccccc5)c5ccccc5)cccc34)c2n1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.39
MAPK1 P28482 2/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 3/20 0.33
ALOX12 P18054 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
NPC1 O15118 1/20 0.31

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
SCHEMBL22707851 0.83 KDM4E (0.38)
SCHEMBL22707103 0.77 MAPK1 (0.45) HSD17B10MAPK1HTTSMN1; SMN2POLB
SCHEMBL22706234 0.76 SMN1; SMN2 (0.42) HSD17B10MAPK1HTTSMN1; SMN2POLB
SCHEMBL22707192 0.75 GPR84 (0.35) HSD17B10MAPK1SMN1; SMN2ALDH1A1MEN1
SCHEMBL22706237 0.75 MAPK1 (0.48) HSD17B10MAPK1HTTSMN1; SMN2POLB
SCHEMBL22707364 0.74 GPR84 (0.35) HSD17B10MAPK1SMN1; SMN2ALDH1A1MEN1
SCHEMBL22707078 0.73 ALDH1A1 (0.36) HSD17B10MAPK1ALOX12ALDH1A1MEN1
SCHEMBL22705934 0.73 GPR84 (0.30)
SCHEMBL22706765 0.73 CES1 (0.40) HSD17B10MAPK1ALDH1A1
SCHEMBL22707064 0.73 THRA (0.32)

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
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 US disclosed