SCHEMBL25459145

SCHEMBL25459145

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc5oc6c(-c7ccc8oc9ccccc9c8c7)cccc6c45)c3)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.49
▸ GGPS1 O95749 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.39
▸ HPGD P15428 3/20 0.39
▸ PLA2G10 O15496 1/20 0.39
▸ PLA2G2A P14555 1/20 0.39
▸ PLA2G4A P47712 1/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ CSNK2A2 P19784 1/20 0.39
▸ CSNK2B P67870 1/20 0.39
▸ PIM3 Q86V86 1/20 0.39
▸ PIM2 Q9P1W9 1/20 0.39
▸ PTGES2 Q9H7Z7 1/20 0.38
▸ PRKDC P78527 1/20 0.38
▸ MAPT P10636 6/20 0.37
▸ POLB P06746 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ CHEK2 O96017 1/20 0.36
▸ KMT2A Q03164 3/20 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
SCHEMBL25459663 0.96 ALOX5 (0.45) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL21898597 0.95 ALOX5 (0.49) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL24264023 0.95 ALOX5 (0.52) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL25458522 0.95 ALOX5 (0.49) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL24217101 0.95 ALOX5 (0.46) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL22760782 0.94 ALOX5 (0.46) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL23822672 0.94 ALOX5 (0.48) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL25458529 0.94 ALOX5 (0.45) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL18216760 0.94 ALOX5 (0.56) ALOX5GGPS1ALDH1A1HPGDPLA2G10
SCHEMBL22737849 0.93 ALOX5 (0.44) ALOX5GGPS1ALDH1A1HPGDPLA2G10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 — — US disclosed
US-20230157151-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-05-18 — — US disclosed
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