SCHEMBL22707141

SCHEMBL22707141

c1ccc(-p2c3ccccc3c3c(-c4cccc5c(-c6ccc7cc8ccccc8cc7c6)c6cccc(-c7cccc8c7c7ccccc7p8-c7ccccc7)c6cc45)cccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.34
▸ PIM1 P11309 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ TSHR P16473 3/20 0.31
▸ HIF1A Q16665 3/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ CASP1 P29466 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ CASP7 P55210 1/20 0.30
▸ CES1 P23141 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ CYP2C9 P11712 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
SCHEMBL22706663 0.96 HDAC4 (0.36) ALOX5PIM1HDAC4HDAC2HDAC8
SCHEMBL22706029 0.91 HDAC4 (0.38) ALOX5PIM1HDAC4HDAC2HDAC8
SCHEMBL22707144 0.87 ALOX5 (0.35) ALOX5PIM1HDAC4HDAC2HDAC8
SCHEMBL22706001 0.86 CES1 (0.39) ALOX5TSHRHIF1AALDH1A1HPGD
SCHEMBL22707121 0.86 — —
SCHEMBL22707369 0.86 — —
SCHEMBL22705952 0.85 — —
SCHEMBL22705951 0.85 ALDH1A1 (0.35) TSHRHIF1AALDH1A1HPGDMAPK1
SCHEMBL22707883 0.85 ALDH1A1 (0.37) TSHRHIF1AALDH1A1HPGDMAPK1
SCHEMBL22707739 0.84 ALDH1A1 (0.34) TSHRHIF1AALDH1A1HPGDMAPK1

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
Send feedback