SCHEMBL31642943

SCHEMBL31642943

N#Cc1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(Cl)ccc4-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 13/20 0.51
▸ ABCB1 P08183 9/20 0.51
▸ ABCC1 P33527 4/20 0.46
▸ ADORA2A P29274 1/20 0.45
▸ ADORA1 P30542 1/20 0.45
▸ SQOR Q9Y6N5 1/20 0.43
▸ GABRA1 P14867 1/20 0.43
▸ GABRG2 P18507 1/20 0.43
▸ GABRB3 P28472 1/20 0.43
▸ GABRA5 P31644 1/20 0.43
▸ GABRA3 P34903 1/20 0.43
▸ HPGD P15428 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ PDE4B Q07343 1/20 0.42
▸ PDE4D Q08499 1/20 0.42

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
SCHEMBL31642628 0.95 ABCG2 (0.47) ABCG2ABCB1ABCC1ADORA2AADORA1
SCHEMBL29313738 0.95 ABCG2 (0.49) ABCG2ABCB1ABCC1ADORA2AADORA1
SCHEMBL31463124 0.90 ADORA2A (0.47) ABCG2ABCB1ABCC1ADORA2AADORA1
SCHEMBL31463167 0.89 ADORA2A (0.48) ABCG2ABCB1ABCC1ADORA2AADORA1
SCHEMBL26591978 0.88 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31463119 0.87 ABCG2 (0.53) ABCG2ABCB1ABCC1ADORA2AADORA1
SCHEMBL31643600 0.85 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31463139 0.85 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31463162 0.85 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2
SCHEMBL31463137 0.85 ABCG2 (0.52) ABCG2ABCB1ABCC1GABRA1GABRG2

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-2025135764-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 솔루스첨단소재 주식회사 2025-06-26 — — WO disclosed
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