SCHEMBL22707997

SCHEMBL22707997

c1ccc2cc3cc(-c4c5cccc(-c6ccc7c8ccccc8n8c9ccccc9c6c78)c5cc5c(-c6ccc7c8ccccc8n8c9ccccc9c6c78)cccc45)ccc3cc2c1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
CES1 P23141 1/20 0.32
FLT3 P36888 2/20 0.31
BMX P51813 1/20 0.30
PIM1 P11309 1/20 0.30
ERBB2 P04626 1/20 0.30
CYP1A2 P05177 1/20 0.30
FYN P06241 1/20 0.30
MAOA P21397 1/20 0.30
ACHE P22303 1/20 0.30
AHR P35869 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
CASP1 P29466 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL22707556 0.96 PIM1 (0.33) ALOX5CES1FLT3BMXPIM1
SCHEMBL22708010 0.91 HDAC4 (0.35) ALOX5FLT3BMXPIM1ALDH1A1
SCHEMBL22708000 0.89 ALOX5 (0.34) ALOX5CES1PIM1ALDH1A1HPGD
SCHEMBL23775774 0.87 HSD17B1 (0.31)
SCHEMBL22707534 0.87 CES1 (0.41) ALOX5CES1ERBB2CYP1A2FYN
SCHEMBL19863136 0.87 GSTP1 (0.34) ALOX5CYP1A2TSHRHIF1A
SCHEMBL22707561 0.86 PIM1 (0.33) ALOX5CES1PIM1CYP1A2ALDH1A1
SCHEMBL22706149 0.85 HSP90AA1 (0.32) HSD17B10
SCHEMBL22707998 0.85 ALOX5 (0.36) ALOX5CES1FLT3BMXPIM1
SCHEMBL22707155 0.85 ALDH1A1 (0.34) CES1FLT3BMXCYP1A2MAOA

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