SCHEMBL28520560

SCHEMBL28520560

CNc1ccc(Nc2ccc(C(C)(C)C)cc2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ MAPK1 P28482 3/20 0.50
▸ MAPT P10636 2/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ EGFR P00533 1/20 0.50
▸ PABPC1 P11940 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ GNG2 P59768 2/20 0.49
▸ GNB1 P62873 2/20 0.49
▸ NPC1 O15118 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ PGAM1 P18669 1/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ TSHR P16473 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ PLA2G1B P04054 1/20 0.44

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
SCHEMBL9242850 0.94 NPC1 (0.50) RAB9AL3MBTL1MAPK1MAPTTDP1
SCHEMBL11536530 0.86 ADORA2A (0.51) RAB9AL3MBTL1MAPK1MAPTTDP1
SCHEMBL31150807 0.85 MAPT (0.59) RAB9AL3MBTL1MAPK1MAPTTDP1
SCHEMBL30922379 0.85 MAPT (0.59) RAB9AL3MBTL1MAPK1MAPTTDP1
SCHEMBL139752 0.85 MAPT (0.59) RAB9AL3MBTL1MAPK1MAPTTDP1
SCHEMBL92477 0.84 P2RY2 (0.55) RAB9AL3MBTL1MAPK1MAPTTDP1
SCHEMBL30513727 0.84 P2RY2 (0.55) RAB9AL3MBTL1MAPK1MAPTTDP1
SCHEMBL29377518 0.84 P2RY2 (0.55) RAB9AL3MBTL1MAPK1MAPTTDP1
SCHEMBL14489850 0.83 AKR1C3 (0.47) RAB9AL3MBTL1MAPK1MAPTSMN1; SMN2
SCHEMBL13962363 0.83 AKR1C3 (0.48) RAB9AMAPK1MAPTSMN1; SMN2NPC1

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
CN-112135941-B Dyed polypropylene fiber structure, garment using same, and anthraquinone compound 学校法人金泽工业大学 2021-11-26 — — CN disclosed
CN-112135941-A Dyed polypropylene fiber structure, garment using same, and anthraquinone compound 学校法人金泽工业大学 2020-12-25 — — CN disclosed
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