SCHEMBL24663124

SCHEMBL24663124

c1ccc(-c2c3ccccc3c(-c3cccc4oc5c(ccc6c7ccccc7oc65)c34)c3ccccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.44
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ GGPS1 O95749 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CSF1R P07333 1/20 0.37
▸ PDGFRB P09619 1/20 0.37
▸ KIT P10721 1/20 0.37
▸ FLT3 P36888 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ ADORA2A P29274 1/20 0.36

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
SCHEMBL24662820 0.97 ALOX5 (0.46) ALOX5CA1CA2GGPS1KDM4E
SCHEMBL23426732 0.94 ALOX5 (0.48) ALOX5CA1CA2GGPS1KDM4E
SCHEMBL23426687 0.94 ALOX5 (0.48) ALOX5CA1CA2GGPS1KDM4E
SCHEMBL24662816 0.93 ALOX5 (0.43) ALOX5CA1CA2GGPS1KDM4E
SCHEMBL24663125 0.92 ALOX5 (0.44) ALOX5CA1CA2GGPS1MAPT
SCHEMBL22546842 0.91 ALOX5 (0.38) ALOX5CA1CA2GGPS1KDM4E
SCHEMBL17932086 0.89 ALOX5 (0.49) ALOX5CA1CA2GGPS1KDM4E
SCHEMBL23426673 0.89 ALOX5 (0.41) ALOX5CA1CA2GGPS1KDM4E
SCHEMBL17932059 0.89 ALOX5 (0.48) ALOX5CA1CA2GGPS1KDM4E
SCHEMBL24663103 0.88 CDC14B (0.38) ALOX5CA1CA2KDM4EALDH1A1

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
WO-2022169218-A1 METHOD FOR PREPARATION OF DEUTERATED ANTHRACENE COMPOUND, REACTION COMPOSITION, DEUTERATED ANTHRACENE COMPOUND, AND COMPOSITION 주식회사 엘지화학 2022-08-11 — — WO disclosed
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