SCHEMBL10779390

SCHEMBL10779390

CCOCCN(CCOCC)/N=N/c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.37
▸ CHRNA7 P36544 1/20 0.36
▸ CHRNA10 Q9GZZ6 1/20 0.36
▸ CHRNA9 Q9UGM1 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ MAPT P10636 5/20 0.35
▸ USP2 O75604 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ CES2 O00748 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ CES1 P23141 1/20 0.33
▸ MEN1 O00255 1/20 0.32

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
SCHEMBL22390702 0.80 ALDH1A1 (0.44) ALDH1A1CHRNA7CHRNA10CHRNA9TDP1
SCHEMBL22390704 0.80 ALDH1A1 (0.44) ALDH1A1CHRNA7CHRNA10CHRNA9TDP1
SCHEMBL9107945 0.80 ALDH1A1 (0.44) ALDH1A1CHRNA7CHRNA10CHRNA9TDP1
SCHEMBL10620092 0.77 ALDH1A1 (0.49) ALDH1A1CHRNA7CHRNA10CHRNA9TDP1
SCHEMBL3500948 0.75 MAPT (0.55) ALDH1A1CHRNA7CHRNA10CHRNA9TDP1
SCHEMBL973244 0.75 MAPT (0.55) ALDH1A1CHRNA7CHRNA10CHRNA9TDP1
SCHEMBL973245 0.75 MAPT (0.55) ALDH1A1CHRNA7CHRNA10CHRNA9TDP1
Water SCHEMBL5373028 0.74 MAPT (0.53) ALDH1A1CHRNA7CHRNA10CHRNA9TDP1
SCHEMBL13803508 0.72 ALDH1A1 (0.57) ALDH1A1TDP1TSHRMAPK1HSD17B10
SCHEMBL10598054 0.72 ALDH1A1 (0.57) ALDH1A1TDP1TSHRMAPK1HSD17B10

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
EP-0134446-B1 NEGATIVE PHOTORESIST FORMULATIONS WITH RADIATION-ABSORBING ADDITIVES MERCK PATENT GmbH (DE) 1987-05-20 — — EP disclosed
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