SCHEMBL7459336

SCHEMBL7459336

COC(=O)c1ccc(Cl)cc1NC(=O)CSc1ccccc1C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.56
WDR77 Q9BQA1 1/20 0.56
MAPT P10636 3/20 0.54
TP53 P04637 1/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
POLB P06746 2/20 0.53
ALDH1A1 P00352 5/20 0.53
HPGD P15428 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
KDM4E B2RXH2 3/20 0.52
LMNA P02545 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
GAA P10253 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
PKM P14618 1/20 0.50

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
SCHEMBL7459655 0.90 ALDH1A1 (0.58) PRMT5WDR77MAPTTP53MEN1
SCHEMBL7466702 0.88 PRMT5 (0.57) PRMT5WDR77MAPTTP53MEN1
SCHEMBL7463833 0.88 PRMT5 (0.55) PRMT5WDR77MAPTTP53MEN1
SCHEMBL7464454 0.85 L3MBTL1 (0.73) PRMT5WDR77MAPTTP53MEN1
SCHEMBL7458969 0.83 MAPT (0.49) MAPTTP53MEN1KMT2APOLB
SCHEMBL7468316 0.82 L3MBTL1 (0.55) PRMT5WDR77MAPTTP53MEN1
SCHEMBL7461852 0.81 L3MBTL1 (0.70) PRMT5WDR77MAPTTP53MEN1
SCHEMBL7466458 0.81 L3MBTL1 (0.57) PRMT5WDR77MAPTTP53MEN1
SCHEMBL8921142 0.81 MEN1 (0.58) PRMT5WDR77MAPTTP53MEN1
SCHEMBL7463414 0.79 L3MBTL1 (0.60) PRMT5WDR77MAPTTP53MEN1

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