SCHEMBL27322846

SCHEMBL27322846

c1ccc(N(c2ccc(-c3cccc4ccccc34)cc2)c2cccc3oc4c5ccccc5ccc4c23)c(-c2ccc3oc4cc5ccccc5cc4c3c2)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.33
▸ CYP1A1 P04798 3/20 0.32
▸ CYP1B1 Q16678 3/20 0.32
▸ CYP1A2 P05177 2/20 0.31
▸ ABCB1 P08183 2/20 0.30
▸ ABCC1 P33527 2/20 0.30
▸ ABCG2 Q9UNQ0 2/20 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
SCHEMBL27385303 0.95 ALOX5 (0.37) ALOX5CYP1A1CYP1B1CYP1A2ABCB1
SCHEMBL27385297 0.94 ALOX5 (0.36) ALOX5CYP1A1CYP1B1CYP1A2ABCB1
SCHEMBL27314247 0.94 ALOX5 (0.37) ALOX5CYP1A1CYP1B1CYP1A2ABCB1
SCHEMBL27324448 0.94 ALOX5 (0.31) ALOX5CYP1A1CYP1B1
SCHEMBL27333056 0.94 ALOX5 (0.34) ALOX5CYP1A1CYP1B1CYP1A2
SCHEMBL27313974 0.93 ALOX5 (0.37) ALOX5CYP1A1CYP1B1CYP1A2ABCB1
SCHEMBL27385137 0.92 ALOX5 (0.37) ALOX5CYP1A1CYP1B1CYP1A2ABCB1
SCHEMBL27322613 0.91 TDP1 (0.33) ALOX5
SCHEMBL27385132 0.91 ALOX5 (0.37) ALOX5CYP1A1CYP1B1CYP1A2ABCB1
SCHEMBL27322741 0.91 CA12 (0.33) ALOX5

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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