SCHEMBL22137201

SCHEMBL22137201

Brc1ccc(Nc2ccc(-c3cc4ccccc4c4ccccc34)cc2)c(-c2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACP1 P24666 1/20 0.41
▸ ABCG2 Q9UNQ0 3/20 0.40
▸ CYP11B1 P15538 1/20 0.39
▸ MAPT P10636 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MPI P34949 1/20 0.39
▸ CDC25B P30305 2/20 0.39
▸ ALK Q9UM73 1/20 0.38
▸ TP53 P04637 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ RXFP1 Q9HBX9 2/20 0.37
▸ THRB P10828 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
SCHEMBL22137050 0.87 CYP11B1 (0.42) ABCG2CYP11B1MAPTALDH1A1HPGD
SCHEMBL22137199 0.86 ALDH1A1 (0.44) ACP1ABCG2MAPTALDH1A1HPGD
SCHEMBL22137197 0.85 ALDH1A1 (0.47) ACP1ABCG2MAPTALDH1A1HPGD
SCHEMBL30597412 0.85 ALDH1A1 (0.47) ACP1ABCG2MAPTALDH1A1HPGD
SCHEMBL24029633 0.84 CDC25B (0.52) ABCG2CYP11B1MAPTALDH1A1HPGD
SCHEMBL12745145 0.84 ABCG2 (0.43) ACP1ABCG2CYP11B1MAPTALDH1A1
SCHEMBL26021757 0.83 CDC25B (0.51) ABCG2CYP11B1MAPTALDH1A1HPGD
SCHEMBL22137200 0.83 ALK (0.41) ACP1ABCG2MAPTALDH1A1MEN1
SCHEMBL26021732 0.83 CDC25B (0.51) ABCG2CYP11B1MAPTALDH1A1HPGD
SCHEMBL12745144 0.83 ABCG2 (0.42) ACP1ABCG2CYP11B1MAPTALDH1A1

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-2020130511-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME 주식회사 엘지화학 2020-06-25 — — WO disclosed
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