SCHEMBL8357877

SCHEMBL8357877

CCN(CC)c1ccc(C=NCCNCc2ccccc2O)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 15/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ ALDH1A1 P00352 13/20 0.55
▸ KDM4E B2RXH2 10/20 0.55
▸ GAA P10253 6/20 0.55
▸ HPGD P15428 5/20 0.55
▸ ALOX12 P18054 1/20 0.55
▸ HTT P42858 4/20 0.54
▸ MAPK1 P28482 3/20 0.54
▸ MEN1 O00255 6/20 0.52
▸ KMT2A Q03164 6/20 0.52
▸ SMN1; SMN2 Q16637 5/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ LMNA P02545 6/20 0.51
▸ TDP1 Q9NUW8 4/20 0.51
▸ CRHBP P24387 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51
▸ PKM P14618 1/20 0.49
▸ TP53 P04637 2/20 0.48

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
SCHEMBL6811530 0.83 MAPT (0.65) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL18435400 0.80 CA12 (0.64) KDM4E
SCHEMBL7106742 0.80 CA12 (0.64) KDM4E
SCHEMBL8357883 0.79 CA2 (0.49) MAPTRAB9ANPC1KDM4EMEN1
SCHEMBL14354212 0.78 MAPT (0.63) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL14354091 0.78 MAPT (0.63) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL14354213 0.78 MAPT (0.63) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL14354131 0.78 MAPT (0.63) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL14354015 0.78 MAPT (0.63) MAPTRAB9ANPC1ALDH1A1KDM4E
SCHEMBL14354014 0.78 MAPT (0.63) MAPTRAB9ANPC1ALDH1A1KDM4E

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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