SCHEMBL22707154

SCHEMBL22707154

c1ccc2c(-c3cccc4c(-c5c6cccc(-c7cccc8c7c7cccc9c%10ccccc%10n8c97)c6cc6c(-c7cccc8c7c7cccc9c%10ccccc%10n8c97)cccc56)c5cccc(-c6cccc7ccccc67)c5cc34)cccc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
TSHR P16473 3/20 0.35
MAPK1 P28482 3/20 0.35
HSD17B10 Q99714 3/20 0.35
CASP1 P29466 2/20 0.35
HIF1A Q16665 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 2/20 0.34
CES1 P23141 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 1/20 0.34
TUBA1B P68363 1/20 0.34
TUBA4A P68366 1/20 0.34

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
SCHEMBL22706903 0.96 ALDH1A1 (0.34) ALDH1A1HPGDTSHRMAPK1HSD17B10
SCHEMBL22707528 0.93 CES1 (0.42) ALDH1A1HPGDTSHRMAPK1HSD17B10
SCHEMBL22707927 0.88 KDM4E (0.34) ALDH1A1HPGDHSD17B10KDM4EMEN1
SCHEMBL22707155 0.88 ALDH1A1 (0.34) ALDH1A1HPGDTSHRMAPK1HSD17B10
SCHEMBL22706189 0.88 KDM4E (0.33) ALDH1A1HPGDHSD17B10KDM4EMEN1
SCHEMBL22708012 0.87 HDAC4 (0.35) ALDH1A1HPGDTSHRMAPK1HSD17B10
SCHEMBL22707157 0.87 KDM4E (0.36) ALDH1A1HPGDKDM4ECES1MEN1
SCHEMBL22706192 0.86 KDM4E (0.34) ALDH1A1HPGDHSD17B10KDM4EMEN1
SCHEMBL22706398 0.86 ALDH1A1 (0.37) ALDH1A1HPGDTSHRMAPK1HSD17B10
SCHEMBL22707561 0.86 PIM1 (0.33) ALDH1A1HPGDTSHRMAPK1HSD17B10

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