SCHEMBL27305685

SCHEMBL27305685

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3-c3ccccc3)c3ccccc3-c3cccc4c3oc3cc5ccccc5cc34)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.34
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ HSD17B1 P14061 1/20 0.31
▸ HSD17B2 P37059 1/20 0.31
▸ PIM1 P11309 1/20 0.30
▸ CSNK2A2 P19784 1/20 0.30
▸ CSNK2B P67870 1/20 0.30
▸ PIM3 Q86V86 1/20 0.30
▸ PIM2 Q9P1W9 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
SCHEMBL27305652 0.98 ALOX5 (0.34) ALOX5CA12CA1CA2CA9
SCHEMBL27305686 0.97 PRKDC (0.33) ALOX5CA12CA1CA2CA9
SCHEMBL27305687 0.97 CA12 (0.37) ALOX5CA12CA1CA2CA9
SCHEMBL27305668 0.95 ALOX5 (0.34) ALOX5CA12CA1CA2CA9
SCHEMBL27305798 0.94 ALOX5 (0.35) ALOX5CA12CA1CA2CA9
SCHEMBL27305787 0.94 ALOX5 (0.36) ALOX5CA12CA1CA2CA9
SCHEMBL27305482 0.94 ALOX5 (0.36) ALOX5CA12CA1CA2CA9
SCHEMBL27305792 0.94 CA12 (0.33) ALOX5CA12CA1CA2CA9
SCHEMBL27305688 0.93 ALOX5 (0.36) ALOX5CA12CA1CA2CA9
SCHEMBL27305805 0.92 ALOX5 (0.36) ALOX5CA12CA1CA2CA9

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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