SCHEMBL8567066

SCHEMBL8567066

CCOC(=O)Oc1cnc2nc(C)c(OCC)cc2c1Nc1ccc(OCCO)cc1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.40
NPC1 O15118 1/20 0.40
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.36
STK4 Q13043 3/20 0.36
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
RAD52 P43351 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC2A1 P11166 1/20 0.35

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
SCHEMBL8562498 0.90 STK4 (0.45) MAPTNPC1KDM4ELMNASTK4
SCHEMBL8567052 0.86 MAPT (0.55) MAPTNPC1LMNATP53SMN1; SMN2
Hydrochloric Acid SCHEMBL8566227 0.85 MAPT (0.54) MAPTNPC1LMNATP53SMN1; SMN2
SCHEMBL8560369 0.85 MAPT (0.44) MAPTNPC1KDM4ESMN1; SMN2
SCHEMBL8559604 0.79 MAPT (0.62) MAPTNPC1KDM4ETP53KMT2A
Hydrochloric Acid SCHEMBL8561142 0.78 MAPT (0.61) MAPTNPC1KDM4ETP53KMT2A
SCHEMBL8567858 0.76 MAPT (0.51) MAPTNPC1LMNATP53SMN1; SMN2
SCHEMBL8566689 0.76 PDE4B (0.43) MAPTNPC1KDM4ESTK4TP53
SCHEMBL8563378 0.76 PDE4B (0.59) MAPTNPC1TP53KMT2ANPSR1
Hydrochloric Acid SCHEMBL8562082 0.76 MAPT (0.51) MAPTNPC1LMNATP53SMN1; SMN2

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-0618916-B1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES KNOLL AG (DE) 1998-09-23 EP claimed