SCHEMBL8322260

SCHEMBL8322260

CCOC(=O)c1cnc2nc(C)c(OCC)cc2c1O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.48
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
HSP90AA1 P07900 1/20 0.41
THRB P10828 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL8324234 0.91 DPP4 (0.51) DPP4KDM4ENPC1MAPTTSHR
SCHEMBL8324245 0.88 TSHR (0.42) DPP4KDM4ENPC1MAPTTSHR
SCHEMBL8327645 0.87 KMT2A (0.51) DPP4KDM4ENPC1MAPTTSHR
SCHEMBL8328855 0.87 DPP4 (0.40) DPP4TSHR
SCHEMBL8558995 0.86 DPP4 (0.46) DPP4KDM4ENPC1MAPTTSHR
SCHEMBL8562829 0.86 ALDH1A1 (0.38) DPP4TSHR
SCHEMBL7507492 0.84 KDM4E (0.44) DPP4KDM4ENPC1MAPTTSHR
SCHEMBL6780202 0.84 KDM4E (0.44) DPP4KDM4ENPC1MAPTTSHR
SCHEMBL8560147 0.81 DPP4 (0.42) DPP4KDM4ENPC1MAPTTSHR
SCHEMBL8560142 0.81 DPP4 (0.42) DPP4KDM4ENPC1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0705260-B1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AG (DE) 1999-03-03 EP disclosed
EP-0618916-B1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES KNOLL AG (DE) 1998-09-23 EP disclosed
US-5780482-A TREATING RHEUMATIC DISEASES KNOLL AKTIENGESELLSCHAFT (DE) 1998-07-14 US disclosed
EP-0705260-A1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AKTIENGESELLSCHAFT (DE) 1996-04-10 EP disclosed
US-5464781-A TREATING RHEUMATIC DISEASES THE BOOTS COMPANY PLC (GB) 1995-11-07 US disclosed
WO-1995000511-A1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AG (DE) 1995-01-05 WO 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
EP-0008610-B1 FURONAPHTHYRIDINE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DAIICHI SEIYAKU CO., LTD. (JP) 1981-10-14 EP disclosed
US-4293695-A ANTIBACTERIAL AGENTS DAIICHI SEIYAKU CO., LTD. (JP) 1981-10-06 US disclosed
EP-0008610-A1 Furonaphthyridine compounds, process for their preparation and pharmaceutical compositions containing them DAIICHI SEIYAKU CO., LTD. (JP) 1980-03-19 EP disclosed