SCHEMBL5670740

SCHEMBL5670740

COc1ccc(N(Cc2ccc(N=N)cc2)C(=O)OCC2c3ccccc3-c3ccccc32)c(OC)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FABP5 Q01469 1/20 0.39
▸ TSHR P16473 5/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ GPR55 Q9Y2T6 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ RAB9A P51151 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ TSPO P30536 2/20 0.34
▸ BCL2A1 Q16548 1/20 0.33
▸ BMP1 P13497 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL28069712 0.90 FABP5 (0.45) FABP5TSHRMEN1KMT2AGPR55
SCHEMBL4784032 0.89 FABP5 (0.41) FABP5TSHRMEN1KMT2AGPR55
SCHEMBL208874 0.89 FABP5 (0.41) FABP5TSHRMEN1KMT2AGPR55
SCHEMBL1526171 0.88 FABP5 (0.40) FABP5TSHRMEN1KMT2AGPR55
SCHEMBL6298094 0.87 FABP5 (0.42) FABP5TSHRMEN1KMT2AHTT
SCHEMBL3433024 0.87 HSD17B10 (0.39) FABP5TSHRMEN1KMT2AGPR55
SCHEMBL5372417 0.86 FABP5 (0.39) FABP5TSHRMEN1KMT2AGPR55
SCHEMBL2637405 0.83 FABP5 (0.39) FABP5MEN1KMT2ATSPOBMP1
SCHEMBL3805522 0.83 BMP1 (0.37) FABP5TSHRMEN1KMT2AGPR55
SCHEMBL17500350 0.83 NPC1 (0.43) FABP5TSHRMEN1KMT2AGPR55

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
US-20060057290-A1 Patterning carbon nanotube coatings by selective chemical modification EIKOS, INC. 2006-03-16 — — US disclosed
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