SCHEMBL8567114

SCHEMBL8567114

CCOC(=O)c1cnc2nc(C)c(OCC)cc2c1Nc1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
DPP4 P27487 5/20 0.46
TP53 P04637 2/20 0.46
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
KMT2A Q03164 1/20 0.45
BRAF P15056 1/20 0.44
THRB P10828 2/20 0.43
GAA P10253 1/20 0.43
PDE4B Q07343 1/20 0.43

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
Hydrochloric Acid SCHEMBL9259992 0.98 MAPT (0.49) MAPTDPP4TP53MEN1ALDH1A1
SCHEMBL8568881 0.92 MAPT (0.47) MAPTDPP4TP53MEN1ALDH1A1
SCHEMBL9544533 0.91 PDE4B (0.50) MAPTTP53MEN1ALDH1A1KMT2A
SCHEMBL8563378 0.86 PDE4B (0.59) MAPTTP53MEN1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL811230 0.85 PDE4B (0.58) MAPTTP53MEN1ALDH1A1KMT2A
SCHEMBL8559604 0.84 MAPT (0.62) MAPTTP53MEN1KMT2ATHRB
Hydrochloric Acid SCHEMBL8561142 0.83 MAPT (0.61) MAPTTP53MEN1KMT2ATHRB
SCHEMBL8558688 0.83 PDE4B (0.60) MAPTTP53MEN1ALDH1A1KMT2A
SCHEMBL8670121 0.82 MAPT (0.49) MAPTTP53MEN1ALDH1A1LMNA
SCHEMBL8327883 0.82 MAPT (0.48) MAPTTP53MEN1ALDH1A1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618916-B1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES KNOLL AG (DE) 1998-09-23 EP disclosed
US-5464781-A TREATING RHEUMATIC DISEASES THE BOOTS COMPANY PLC (GB) 1995-11-07 US disclosed
EP-0618916-A1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES Knoll AG (DE) 1994-10-12 EP disclosed
WO-1993013097-A1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1993-07-08 WO disclosed