SCHEMBL23823848

SCHEMBL23823848

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc5oc6ccccc6c5cc4-c4ccc5c(c4)oc4ccccc45)n3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.41
▸ MAPT P10636 7/20 0.41
▸ ALDH1A1 P00352 6/20 0.41
▸ HPGD P15428 6/20 0.41
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ MMP12 P39900 1/20 0.40
▸ MMP13 P45452 1/20 0.40
▸ HCRTR1 O43613 1/20 0.39
▸ TTR P02766 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ PLA2G2A P14555 1/20 0.37

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
SCHEMBL23118297 0.96 MMP12 (0.42) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL25458156 0.94 PLA2G2A (0.43) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL25458264 0.94 AHR (0.41) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL24701717 0.94 AHR (0.44) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL24525897 0.94 AHR (0.44) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL24526077 0.94 AHR (0.44) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL22884378 0.93 PLA2G2A (0.43) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL22884882 0.93 PLA2G2A (0.43) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL23385154 0.91 AHR (0.41) AHRMAPTALDH1A1HPGDMEN1
SCHEMBL22058012 0.91 AHR (0.41) AHRMAPTALDH1A1HPGDMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 — — US disclosed
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 — — US disclosed
WO-2021180625-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2021-09-16 — — WO disclosed
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