SCHEMBL7358028

SCHEMBL7358028

Cc1ccc(/C=c2\[nH]c(=O)/c(=C/c3ccc(SCCN(C)C)s3)[nH]c2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 10/20 1.00
PIM1 P11309 1/20 0.32
HPGD P15428 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
LMNA P02545 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
SCHEMBL7358033 1.00 SERPINE1 (1.00) SERPINE1PIM1HPGDPIM2LMNA
SCHEMBL7359539 0.90 SERPINE1 (0.82) SERPINE1PIM1HPGDPIM2LMNA
SCHEMBL7353987 0.90 SERPINE1 (1.00) SERPINE1PIM1PIM2
SCHEMBL7363192 0.90 SERPINE1 (0.82) SERPINE1PIM1PIM2LMNA
SCHEMBL7359534 0.90 SERPINE1 (0.82) SERPINE1PIM1HPGDPIM2LMNA
SCHEMBL7363197 0.90 SERPINE1 (0.82) SERPINE1PIM1PIM2LMNA
SCHEMBL7353995 0.90 SERPINE1 (1.00) SERPINE1PIM1PIM2
SCHEMBL7359291 0.90 SERPINE1 (1.00) SERPINE1
SCHEMBL7359303 0.90 SERPINE1 (1.00) SERPINE1
SCHEMBL7362456 0.89 SERPINE1 (0.80) SERPINE1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995032190-A2 PHARMACEUTICAL DIKETOPIPERAZINE COMPOUNDS XENOVA LIMITED (GB) 1995-11-30 WO claimed
US-5750530-A PLASMINOGEN ACTIVATOR INHIBITORS XENOVA LIMITED (GB) 1998-05-12 US disclosed