SCHEMBL8565860

SCHEMBL8565860

CCOc1cc2c(Nc3ccc(OC)cc3)cc(C)nc2nc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
RAD52 P43351 1/20 0.54
LMNA P02545 2/20 0.52
SLC2A1 P11166 3/20 0.50
EHMT2 Q96KQ7 1/20 0.50
MEN1 O00255 1/20 0.48
PKM P14618 1/20 0.48
KMT2A Q03164 1/20 0.48
PDE4B Q07343 1/20 0.45
PDE4D Q08499 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TP53 P04637 2/20 0.45
ATM Q13315 1/20 0.45
MAPT P10636 3/20 0.43
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
RAB9A P51151 1/20 0.41

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 SCHEMBL8567040 0.99 LMNA (0.54) POLBRAD52LMNASLC2A1EHMT2
SCHEMBL8559967 0.86 PDGFRA (0.48) POLBRAD52LMNASLC2A1EHMT2
Hydrochloric Acid SCHEMBL8566059 0.85 HTT (0.50) POLBRAD52LMNASLC2A1EHMT2
Water SCHEMBL8328226 0.85 PDGFRA (0.47) POLBRAD52LMNASLC2A1EHMT2
SCHEMBL8561356 0.78 PDE4B (0.44) POLBRAD52LMNASLC2A1MEN1
SCHEMBL8566080 0.76 PDE4B (0.43) POLBRAD52SLC2A1MEN1KMT2A
Hydrochloric Acid SCHEMBL8561034 0.76 PDE4B (0.43) POLBRAD52LMNASLC2A1MEN1
SCHEMBL8563461 0.75 PDE4B (0.41) POLBRAD52LMNASLC2A1MEN1
Hydrochloric Acid SCHEMBL8564884 0.75 MAP2K1 (0.41) POLBRAD52SLC2A1MEN1KMT2A
SCHEMBL8560347 0.74 ERBB2 (0.52) POLBRAD52SLC2A1EHMT2KMT2A

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 3 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
WO-1993013097-A1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1993-07-08 WO disclosed