SCHEMBL8557571

SCHEMBL8557571

NNC(N)CCN1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.38
DUSP3 P51452 1/20 0.38
ANPEP P15144 1/20 0.38
GAA P10253 1/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.37
GLA P06280 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL8557174 0.89 KEAP1 (0.52) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL8558962 0.87 KEAP1 (0.50) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL8557810 0.85 KEAP1 (0.48) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL8557309 0.85 KEAP1 (0.48) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL8555711 0.85 KEAP1 (0.48) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL8557644 0.85 KEAP1 (0.48) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL8554312 0.79 USP2 (0.50) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL4796080 0.79 KEAP1 (0.52) KEAP1SMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL27925537 0.78 USP2 (0.45) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL27586193 0.75 USP2 (0.50) KEAP1SMN1; SMN2KDM4EALDH1A1LMNA

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-0575954-B1 Aminoalkylcarbamic esters of eseroline suitable for use as cholinesterase acitivity inhibitors and relative preparation process MEDIOLANUM FARMACEUTICI SRL (IT) 1998-09-02 EP disclosed