SCHEMBL11553644

SCHEMBL11553644

CCOC(=O)c1ccc2nc(-c3cccc(OC)c3OCC)[nH]c(=O)c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ HPGD P15428 2/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ GUSB P08236 2/20 0.50
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ PDE10A Q9Y233 1/20 0.43
▸ POLB P06746 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ PDE5A O76074 1/20 0.43
▸ PKN1 Q16512 1/20 0.42
▸ PKN2 Q16513 1/20 0.42
▸ PDGFRB P09619 1/20 0.42
▸ PDGFRA P16234 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
SCHEMBL11556023 0.93 GUSB (0.51) ALDH1A1KDM4EHPGDHSD17B10GUSB
SCHEMBL11549471 0.91 GUSB (0.53) GUSBMEN1KMT2APDE10APOLB
SCHEMBL11554732 0.90 GUSB (0.45) ALDH1A1KDM4EHPGDHSD17B10GUSB
SCHEMBL11553799 0.90 GUSB (0.44) ALDH1A1KDM4EHPGDHSD17B10GUSB
SCHEMBL11553336 0.90 GUSB (0.51) GUSBMEN1KMT2APDE10APOLB
SCHEMBL11375840 0.89 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDHSD17B10GUSB
SCHEMBL11549502 0.88 MEN1 (0.46) ALDH1A1KDM4EHPGDHSD17B10GUSB
SCHEMBL11553024 0.85 GUSB (0.57) ALDH1A1KDM4EHPGDHSD17B10GUSB
SCHEMBL11554055 0.83 GUSB (0.55) ALDH1A1KDM4EHPGDHSD17B10GUSB
SCHEMBL11554449 0.83 GUSB (0.47) GUSBMEN1KMT2APDE10APOLB

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-4159330-A ANTIALLERGENS CARLO ERBA S.P.A. (IT) 1979-06-26 — — US disclosed
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