SCHEMBL8357883

SCHEMBL8357883

COc1ccc(C=NCCNCc2ccccc2O)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 7/20 0.49
▸ CA12 O43570 6/20 0.49
▸ CA9 Q16790 5/20 0.49
▸ CA1 P00915 1/20 0.49
▸ MPO P05164 3/20 0.48
▸ ADORA2A P29274 1/20 0.47
▸ MAOB P27338 1/20 0.46
▸ TRIM24 O15164 1/20 0.46
▸ TYR P14679 1/20 0.46
▸ TRIM33 Q9UPN9 1/20 0.46
▸ HSD17B10 Q99714 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ HTR2A P28223 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
SCHEMBL7106742 0.82 CA12 (0.64) CA2CA12CA9MPOHSD17B10
SCHEMBL18435400 0.82 CA12 (0.64) CA2CA12CA9MPOHSD17B10
SCHEMBL17743543 0.80 CA2 (0.64) CA2CA12CA9CA1ADORA2A
SCHEMBL17743542 0.80 CA2 (0.64) CA2CA12CA9CA1ADORA2A
SCHEMBL8356137 0.79 CA2 (0.47) CA2CA12CA9CA1ADORA2A
SCHEMBL8357877 0.79 MAPT (0.58) KDM4EL3MBTL1KMT2AMEN1MAPT
SCHEMBL8352623 0.79 CA12 (0.65) CA2CA12CA9MPOADORA2A
SCHEMBL5389476 0.76 CA2 (0.60) CA2CA12CA9CA1ADORA2A
SCHEMBL14354286 0.76 CA2 (0.60) CA2CA12CA9CA1ADORA2A
SCHEMBL14354283 0.76 CA2 (0.60) CA2CA12CA9CA1ADORA2A

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-5998645-A LAUNDERING DETERGENTS; CLEANING COMPOUNDS CLARIANT GMBH (DE) 1999-12-07 — — US disclosed
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