SCHEMBL11605682

SCHEMBL11605682

O=C(c1ccccc1)c1ccc(Nc2cccc3c2C(=O)c2c(O)ccc(O)c2C3=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK13 O15264 4/20 0.51
▸ MAPK12 P53778 4/20 0.51
▸ MAPK11 Q15759 4/20 0.51
▸ MAPK14 Q16539 4/20 0.51
▸ MAPT P10636 4/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ KMT2A Q03164 4/20 0.51
▸ LMNA P02545 3/20 0.51
▸ TDP1 Q9NUW8 3/20 0.51
▸ MAPK1 P28482 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ PRKCA P17252 2/20 0.46
▸ MAOA P21397 4/20 0.45
▸ TSHR P16473 3/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ STK10 O94804 1/20 0.42
▸ SLK Q9H2G2 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
SCHEMBL11604371 0.94 MEN1 (0.48) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL11601923 0.91 MEN1 (0.46) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL11601756 0.91 MAPK13 (0.57) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL11606733 0.90 MAPT (0.46) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL11604431 0.89 MAPK13 (0.56) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL11604248 0.88 MAPK13 (0.56) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL11605483 0.88 MAPT (0.56) MAPTMEN1KMT2ALMNATDP1
SCHEMBL11652815 0.85 MAPT (0.54) MAPTMEN1KMT2ALMNATDP1
SCHEMBL11605704 0.85 MAPT (0.60) MAPTMEN1KMT2ALMNATDP1
SCHEMBL6245049 0.83 MAPK13 (0.50) MAPK13MAPK12MAPK11MAPK14MAPT

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-4128396-A Process for the improvement of dyeing properties of pigments of the anilino and arylmercapto anthraquinone series CIBA-GEIGY CORPORATION (US) 1978-12-05 — — US disclosed
US-3975410-A Process for the manufacture of halogen-containing anthraquinoidal compounds, their use and new halogen-containing anthraquinoidal compounds CIBA-GEIGY CORPORATION (US) 1976-08-17 — — US disclosed
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