SCHEMBL6565238

SCHEMBL6565238

CCOCCCOc1ccc2nc(C(C)=O)c(O)cc2c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 11/20 0.47
PDE3A Q14432 11/20 0.47
P2RY12 Q9H244 10/20 0.47
NCF1 P14598 2/20 0.47
KMT2A Q03164 1/20 0.44
MAOB P27338 4/20 0.43
PPARD Q03181 1/20 0.41
EP300 Q09472 1/20 0.39

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
SCHEMBL6565261 0.90 PDE3B (0.47) PDE3BPDE3AP2RY12MAOB
SCHEMBL8628574 0.87 PDE3B (0.44) PDE3BPDE3AP2RY12KMT2AMAOB
SCHEMBL6567189 0.86 THRA (0.48) PDE3BPDE3AP2RY12MAOB
SCHEMBL6565277 0.83 EGLN1 (0.47) PDE3BPDE3AP2RY12KMT2A
SCHEMBL8627840 0.81 KMT2A (0.52) PDE3BPDE3AP2RY12NCF1KMT2A
SCHEMBL6567169 0.77 ALDH1A1 (0.52) PDE3BPDE3ANCF1KMT2A
SCHEMBL8628704 0.75 KMT2A (0.53) PDE3BPDE3AP2RY12NCF1KMT2A
SCHEMBL8625388 0.75 EGLN1 (0.41) KMT2A
SCHEMBL6565239 0.75 PDE3B (0.49) PDE3BPDE3AKMT2A
SCHEMBL8628688 0.74 HTT (0.41) PDE3BPDE3AP2RY12KMT2A

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-0765871-B1 Substituted Quinoline-2-carboxamides, their preparation and their use as prolyle-4-hydroxylase Inhibitors FIBROGEN INC (US) 2004-03-31 EP disclosed
US-5726305-A Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-10 US disclosed
US-5719164-A Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1998-02-17 US disclosed
EP-0765871-A1 Substituted Quinoline-2-carboxamides, their preparation and their use as prolyle-4-hydroxylase Inhibitors HOECHST AKTIENGESELLSCHAFT (DE) 1997-04-02 EP disclosed