SCHEMBL7357263

SCHEMBL7357263

CN(C)CCSc1ccc(C=c2[nH]c(=O)c(=Cc3cccc(Cl)c3)[nH]c2=O)s1

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 10/20 0.79
GAA P10253 1/20 0.35
PIM1 P11309 2/20 0.33
PIM2 Q9P1W9 2/20 0.33
PRF1 P14222 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
ALOX5 P09917 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
ACHE P22303 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL7357253 1.00 SERPINE1 (0.79) SERPINE1GAAPIM1PIM2PRF1
SCHEMBL7358600 0.89 SERPINE1 (0.78) SERPINE1PIM1PIM2TAAR1
SCHEMBL7358612 0.89 SERPINE1 (0.78) SERPINE1PIM1PIM2TAAR1
SCHEMBL7359534 0.89 SERPINE1 (0.82) SERPINE1PIM1PIM2MEN1KMT2A
SCHEMBL7359539 0.89 SERPINE1 (0.82) SERPINE1PIM1PIM2MEN1KMT2A
SCHEMBL7359303 0.88 SERPINE1 (1.00) SERPINE1
SCHEMBL7359291 0.88 SERPINE1 (1.00) SERPINE1
SCHEMBL7359731 0.88 SERPINE1 (0.74) SERPINE1
SCHEMBL7359738 0.88 SERPINE1 (0.74) SERPINE1
SCHEMBL7362557 0.87 SERPINE1 (0.79) SERPINE1PIM1PIM2MEN1KMT2A

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-5750530-A PLASMINOGEN ACTIVATOR INHIBITORS XENOVA LIMITED (GB) 1998-05-12 US disclosed
EP-0760812-A1 PHARMACEUTICAL DIKETOPIPERAZINE COMPOUNDS XENOVA LIMITED (GB) 1997-03-12 EP disclosed
WO-1995032190-A2 PHARMACEUTICAL DIKETOPIPERAZINE COMPOUNDS XENOVA LIMITED (GB) 1995-11-30 WO disclosed