SCHEMBL8563461

SCHEMBL8563461

CCOc1cc2c(Nc3ccc(OC)cc3)c(CO)cnc2nc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.41
STK4 Q13043 1/20 0.41
PDE4D Q08499 1/20 0.41
DHFR P00374 1/20 0.41
CSF1R P07333 1/20 0.40
MAPT P10636 6/20 0.40
POLB P06746 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 3/20 0.40
RAD52 P43351 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM1A O60341 1/20 0.39
GFER P55789 1/20 0.39
MAP2K1 Q02750 1/20 0.39
SLC2A1 P11166 1/20 0.39
TP53 P04637 4/20 0.39
SMN1; SMN2 Q16637 2/20 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
SCHEMBL8561356 0.87 PDE4B (0.44) PDE4BSTK4PDE4DDHFRCSF1R
Hydrochloric Acid SCHEMBL8561034 0.85 PDE4B (0.43) PDE4BSTK4PDE4DDHFRCSF1R
SCHEMBL8566080 0.85 PDE4B (0.43) PDE4BSTK4PDE4DDHFRCSF1R
SCHEMBL9542072 0.85 PDE4B (0.43) PDE4BMAPTPOLBKMT2ANPSR1
SCHEMBL8564146 0.84 CSF1R (0.50) PDE4BSTK4CSF1RMAPTKMT2A
Hydrochloric Acid SCHEMBL8564884 0.83 MAP2K1 (0.41) PDE4BSTK4PDE4DDHFRCSF1R
SCHEMBL8559603 0.83 DHFR (0.41) PDE4BSTK4PDE4DDHFRCSF1R
SCHEMBL8565303 0.83 CSF1R (0.62) PDE4BCSF1R
SCHEMBL8563378 0.83 PDE4B (0.59) PDE4BCSF1RMAPTKMT2ANPSR1
SCHEMBL8325684 0.82 MAP2K1 (0.61) STK4MAP2K1

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