SCHEMBL6564057

SCHEMBL6564057

CCCCCCCCOc1ccc([N+](=O)[O-])c(C(=O)CC(=O)CC(C)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 2/20 0.49
MAPT P10636 3/20 0.45
PTPN11 Q06124 3/20 0.44
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
THRA P10827 5/20 0.43
THRB P10828 5/20 0.43
ESR1 P03372 1/20 0.42

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
SCHEMBL6566280 0.97 MAPT (0.48) PLA2G4BMAPTLMNAMAPK1KMT2A
SCHEMBL8633004 0.88 MAPT (0.42) PLA2G4BMAPTLMNAMAPK1KMT2A
SCHEMBL8628560 0.82 PTPN11 (0.60) PLA2G4BMAPTPTPN11
SCHEMBL6564101 0.82 SMN1; SMN2 (0.47) MAPTLMNAMAPK1KMT2ASMN1; SMN2
SCHEMBL6566219 0.80 ALDH1A1 (0.41) MAPTLMNAKMT2ASMN1; SMN2
SCHEMBL8629258 0.80 PLA2G4B (0.51) PLA2G4BMAPTPTPN11LMNAMAPK1
SCHEMBL4255397 0.78 TDP1 (0.55) PLA2G4BMAPTLMNAMAPK1KMT2A
SCHEMBL6564212 0.78 MEN1 (0.40) MAPTLMNAKMT2ASMN1; SMN2THRB
SCHEMBL6565266 0.78 SIRT6 (0.45) MAPTMAPK1KMT2ASMN1; SMN2
SCHEMBL8381314 0.78 MAPT (0.56) PLA2G4BMAPTPTPN11LMNAMAPK1

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 7 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
CN-1120157-C Substituted quinoline-2-carboxamides, process for their preparation and their use as pharmaceuticals, and intermediates thereof FIBER GENE CORP (US) 2003-09-03 CN disclosed
CN-1282737-A Intermediate product used for preparing substituted quinoline-2-formamide MOECHST AG (DE) 2001-02-07 CN 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
CN-1154365-A Substituted quinoline-2-carboxamides, process for their preparation and their use as pharmaceuticals, and intermediates thereof HOECHST AG (DE) 1997-07-16 CN 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