SCHEMBL8628533

SCHEMBL8628533

COc1ccc(S(=O)(=O)c2ccc3nc(C(=O)NCC(=O)O)c(O)cc3c2)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
EGLN1 Q9GZT9 12/20 0.43
NAMPT P43490 4/20 0.41
FTO Q9C0B1 3/20 0.39
EGLN3 Q9H6Z9 2/20 0.39
HIF1AN Q9NWT6 2/20 0.39
KDM6B O15054 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
KDM5B Q9UGL1 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
VEGFA P15692 1/20 0.38
FLT1 P17948 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL8629988 0.89 EGLN1 (0.48) EGLN1FTOHIF1AN
SCHEMBL8629876 0.86 EGLN1 (0.51) EGLN1NAMPTFTOHIF1ANPDE4B
SCHEMBL6564105 0.85 EGLN1 (0.48) EGLN1NAMPTFTOEGLN3HIF1AN
SCHEMBL8629264 0.83 EGLN1 (0.51) EGLN1FTOEGLN3HIF1ANKDM5B
SCHEMBL8628250 0.83 EGLN1 (0.46) EGLN1FTOEGLN3HIF1ANKDM6B
SCHEMBL8629451 0.83 EGLN1 (0.55) EGLN1FTOEGLN3HIF1ANKDM6B
SCHEMBL6567419 0.83 EGLN1 (0.51) EGLN1FTOEGLN3HIF1ANKDM5B
SCHEMBL8630076 0.83 EGLN1 (0.45) EGLN1EGLN3
SCHEMBL8629275 0.82 EGLN1 (0.44) EGLN1NAMPTFTOEGLN3HIF1AN
SCHEMBL8628694 0.82 EGLN1 (0.45) EGLN1FTOEGLN3HIF1ANKDM5B

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
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