SCHEMBL7378340

SCHEMBL7378340

CC(C)(C)OC(=O)CN(Cc1cccnc1)S(=O)(=O)c1ccc2c(N(Cl)C(=N)N)cncc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.42
PDE4B Q07343 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
MMP1 P03956 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
ADAM17 P78536 1/20 0.38
ALDH1A1 P00352 3/20 0.38
PTGER2 P43116 5/20 0.38
PLAU P00749 1/20 0.36
NR1D1 P20393 2/20 0.35
KMT2A Q03164 2/20 0.35
ADRB2 P07550 1/20 0.35
MAPK1 P28482 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA9 Q16790 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
SCHEMBL7049621 0.93 PLAU (0.42) PDE4APDE4BPDE4CPDE4DMMP1
SCHEMBL7377975 0.91 PLAU (0.36) PDE4APDE4BPDE4CPDE4DMMP1
SCHEMBL6434466 0.90 NR1D1 (0.35) PLAUNR1D1
Hydrochloric Acid SCHEMBL7371405 0.89 PLAU (0.38) MMP1MMP9MMP13PTGER2PLAU
Hydrochloric Acid SCHEMBL7371889 0.88 TAS2R14 (0.41) MMP9MMP13ADAM17ALDH1A1PTGER2
SCHEMBL7367639 0.88 ALDH1A1 (0.42) ALDH1A1PTGER2CXCR3LMNA
Hydrochloric Acid SCHEMBL6437621 0.87 PLAU (0.46) PDE4APDE4BPDE4CPDE4DMMP1
SCHEMBL7378426 0.87 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL6436322 0.86 NR1D1 (0.37) PLAUNR1D1MAPK1LMNA
SCHEMBL7050063 0.84 PLAU (0.38) ALDH1A1PLAUNR1D1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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