SCHEMBL8628951

SCHEMBL8628951

CCCc1ccc(S(=O)(=O)c2ccc3nc(C(=O)NCC(=O)O)c(O)cc3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 14/20 0.43
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA9 Q16790 2/20 0.42
EGLN3 Q9H6Z9 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FTO Q9C0B1 2/20 0.38
KDM5B Q9UGL1 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
VEGFA P15692 1/20 0.38
FLT1 P17948 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
SCHEMBL8628375 0.94 EGLN1 (0.42) EGLN1CA1CA2CA9EGLN3
SCHEMBL6564105 0.87 EGLN1 (0.48) EGLN1CA1CA2EGLN3FTO
SCHEMBL8632089 0.87 EGLN1 (0.50) EGLN1EGLN3FTOKDM5BKDM2A
SCHEMBL8625366 0.85 EGLN1 (0.44) EGLN1CA1CA2CA9EGLN3
SCHEMBL8751144 0.85 EGLN1 (0.44) EGLN1CA1CA2CA9EGLN3
SCHEMBL8629264 0.85 EGLN1 (0.51) EGLN1EGLN3FTOKDM5BKDM2A
SCHEMBL6567419 0.85 EGLN1 (0.51) EGLN1CA1CA2EGLN3FTO
SCHEMBL8628250 0.85 EGLN1 (0.46) EGLN1CA1CA2EGLN3FTO
SCHEMBL8630076 0.85 EGLN1 (0.45) EGLN1EGLN3ALDH1A1
SCHEMBL8629988 0.84 EGLN1 (0.48) EGLN1KDM4EHPGDSMN1; SMN2FTO

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
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