SCHEMBL7467237

SCHEMBL7467237

COC(=O)c1c(Cl)cc(Cl)cc1NC(=O)CSc1cccc(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
KMT2A Q03164 2/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
TP53 P04637 1/20 0.52
MAPK1 P28482 1/20 0.52
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 4/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
CYP2D6 P10635 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HTT P42858 1/20 0.45

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
SCHEMBL7462894 0.88 KDM4E (0.64) KDM4EKMT2AL3MBTL1TP53NPC1
SCHEMBL7461318 0.84 L3MBTL1 (0.58) KDM4EKMT2AL3MBTL1TP53MAPK1
SCHEMBL7459783 0.82 ALDH1A1 (0.53) KDM4EKMT2AL3MBTL1TP53MAPK1
SCHEMBL7461619 0.81 ALDH1A1 (0.52) KDM4EKMT2AL3MBTL1TP53MAPK1
SCHEMBL7456883 0.80 ALDH1A1 (0.53) KDM4EKMT2AL3MBTL1TP53SMN1; SMN2
SCHEMBL7462906 0.80 MAPT (0.51) KDM4EKMT2AL3MBTL1TP53SMN1; SMN2
SCHEMBL7461299 0.79 KMT2A (0.53) KDM4EKMT2AL3MBTL1TP53MAPK1
SCHEMBL7458969 0.78 MAPT (0.49) KDM4EKMT2AL3MBTL1TP53SMN1; SMN2
SCHEMBL7453231 0.77 SMN1; SMN2 (0.47) KDM4EKMT2AL3MBTL1TP53SMN1; SMN2
SCHEMBL7456897 0.77 KMT2A (0.48) KDM4EKMT2ANPC1RAB9ASMN1; SMN2

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-0869122-B1 Quinolinic sulfide derivatives acting as NMDA receptor antagonists and process for preparation thereof KOREA RES INST CHEM TECH (KR) 2002-12-04 EP disclosed
US-5990126-A 4-HYDROXY-QUINOLIN-2-ONE DERIVATIVES SUBSTITUTED AT POSITION 3 WITH A SUBSTITUTED AROMATIC- OR HETEROAROMATIC-SULFIDE GROUP; ANTAGONIST OF EXCITATORY AMINO ACID FOR NMDA RECEPTORS; TREATING EPILEPSY, STROKE, PARKINSON'S DISEASE KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1999-11-23 US disclosed
EP-0869122-A1 Quinolinic sulfide derivatives acting as NMDA receptor antagonists and process for preparation thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1998-10-07 EP disclosed