SCHEMBL7050306

SCHEMBL7050306

CC(C)(C)OC(=O)CNS(=O)(=O)c1ccc2c(NC(N)=NCl)cncc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 4/20 0.37
F2 P00734 5/20 0.35
TMPRSS6 Q8IU80 2/20 0.35
ACACB O00763 1/20 0.34
PDK1 Q15118 4/20 0.33
PDK2 Q15119 4/20 0.33
PDK3 Q15120 4/20 0.33
PDK4 Q16654 4/20 0.33
PLG P00747 1/20 0.33
PLAT P00750 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
S1PR1 P21453 1/20 0.32

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
SCHEMBL7367638 0.91 S1PR1 (0.40) PLAUF2TMPRSS6ACACBPDK1
SCHEMBL7369185 0.86 PLAU (0.36) PLAUF2TMPRSS6PDK1PDK2
SCHEMBL7375649 0.85 NR1D1 (0.35) PLAUPDK1PDK2PDK3PDK4
SCHEMBL7370338 0.85 PLAU (0.34) PLAUF2PLGPLATALDH1A1
SCHEMBL7050066 0.84 PLAU (0.39) PLAUALDH1A1GAASMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL7363441 0.83 PLAU (0.53) PLAUPDK1PDK2PDK3PDK4
SCHEMBL7367816 0.82 PTPRC (0.42) F2KDM4EMAPT
SCHEMBL7368090 0.81 PLAU (0.51) PLAUPLGPLATKDM4EALDH1A1
Hydrochloric Acid SCHEMBL7366812 0.81 PLAU (0.42) PLAUPDK1PDK2PDK3PDK4
SCHEMBL7365021 0.81 MMP2 (0.36) PLAUPLGPLAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003013523-A1 SH3 PROTEIN DOMAINS AND THEIR LIGANDS ADELAIDE RESEARCH & INNOVATION PTY LTD (AU) 2003-02-20 WO claimed
WO-2003013523-A1 SH3 PROTEIN DOMAINS AND THEIR LIGANDS ADELAIDE RESEARCH & INNOVATION PTY LTD (AU) 2003-02-20 WO disclosed
EP-1242120-A2 COMBINATIONS OF GROWTH FACTORS AND I:UPA OR I:MMP FOR THE TREATMENT OF DAMAGED TISSUE Pfizer Limited (GB) 2002-09-25 EP disclosed
WO-2001049309-A2 COMBINATIONS OF GROWTH FACTORS AND I: UPA OR I: MMP FOR THE TREATMENT OF DAMAGED TISSUE PFIZER LIMITED (GB) 2001-07-12 WO disclosed
EP-1077945-A1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER INC. (US) 2001-02-28 EP disclosed
WO-2000005214-A2 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER INC. (US) 2000-02-03 WO disclosed