SCHEMBL8238043

SCHEMBL8238043

CN(C)CCSc1ccc(/C=C/C(=O)CC(=O)/C=C/c2ccc(SCCN(C)C)s2)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 8/20 0.49
MAPT P10636 3/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
MITF O75030 1/20 0.36
TOP2A P11388 1/20 0.35
ABL1 P00519 1/20 0.35
RECQL P46063 1/20 0.34
HTT P42858 2/20 0.34
MAPK1 P28482 2/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KMT2A Q03164 3/20 0.34
HTR2A P28223 2/20 0.34
HTR2C P28335 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
GP6 Q9HCN6 1/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL8624418 0.79 SERPINE1 (0.54) SERPINE1ALDH1A1RECQLHTR2AHTR1A
SCHEMBL14363101 0.69 SERPINE1 (0.45) SERPINE1HTR2AHTR1AHTR7
SCHEMBL7361138 0.69 SERPINE1 (0.44) SERPINE1ALDH1A1KDM4ESMN1; SMN2SIGMAR1
SCHEMBL7362526 0.66 SERPINE1 (0.75) SERPINE1MAPTALDH1A1LMNAHTT
SCHEMBL7362519 0.66 SERPINE1 (0.75) SERPINE1MAPTALDH1A1LMNAHTT
SCHEMBL7359303 0.65 SERPINE1 (1.00) SERPINE1HTR2ACYP2D6HTR1AHTR7
SCHEMBL7363678 0.65 SERPINE1 (0.72) SERPINE1HTR7
SCHEMBL7359291 0.65 SERPINE1 (1.00) SERPINE1HTR2ACYP2D6HTR1AHTR7
SCHEMBL7363682 0.65 SERPINE1 (0.72) SERPINE1HTR7
SCHEMBL7358033 0.65 SERPINE1 (1.00) SERPINE1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007051314-A1 CURCUMINOID COMPOUNDS FOR INHIBITING PLASMINOGEN ACTIVATOR INHIBITOR-1 AMERICAN DIAGNOSTICA INC. (US) 2007-05-10 WO disclosed