SCHEMBL27305481

SCHEMBL27305481

c1ccc(-c2ccc(-c3ccccc3N(c3ccccc3)c3ccccc3-c3cccc4c3oc3cc5ccccc5cc34)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.36
▸ PRKDC P78527 4/20 0.31
▸ CRHR1 P34998 1/20 0.31
▸ GPR84 Q9NQS5 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.30
▸ ADORA2A P29274 1/20 0.30
▸ ADORA1 P30542 1/20 0.30
▸ GGPS1 O95749 1/20 0.30
▸ KDM4E B2RXH2 2/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ PIK3CD O00329 2/20 0.30
▸ PIK3CA P42336 2/20 0.30
▸ PIK3CB P42338 2/20 0.30
▸ PIK3CG P48736 2/20 0.30
▸ PTGES O14684 1/20 0.30
▸ MAOB P27338 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
SCHEMBL27305787 0.98 ALOX5 (0.36) ALOX5PRKDCCRHR1GPR84CA12
SCHEMBL27305482 0.98 ALOX5 (0.36) ALOX5PRKDCCRHR1GPR84CA12
SCHEMBL27305798 0.95 ALOX5 (0.35) ALOX5PRKDCCRHR1GPR84CA12
SCHEMBL27305652 0.94 ALOX5 (0.34) ALOX5CA12CA1CA2CA9
SCHEMBL27305964 0.94 ALOX5 (0.34) ALOX5PRKDCCA12CA1CA2
SCHEMBL27305484 0.94 ALOX5 (0.39) ALOX5PRKDCGPR84CA12CA1
SCHEMBL27305941 0.93 ALOX5 (0.35) ALOX5CA12CA1CA2CA9
SCHEMBL27305790 0.93 ALOX5 (0.38) ALOX5PRKDCCRHR1GGPS1ALDH1A1
SCHEMBL27305685 0.92 ALOX5 (0.34) ALOX5CA12CA1CA2CA9
SCHEMBL27305788 0.92 ALOX5 (0.36) ALOX5PRKDCCA12CA1CA2

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-2023199832-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-10-19 — — WO disclosed
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