SCHEMBL7368832

SCHEMBL7368832

NC(=NCl)Nc1cncc2cc(S(=O)(=O)N[C@@H](Cc3ccccc3)C(=O)OC(=O)C(F)(F)F)ccc12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F2 P00734 8/20 0.40
TMPRSS6 Q8IU80 8/20 0.40
POLB P06746 1/20 0.37
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
MMP2 P08253 5/20 0.36
MMP9 P14780 3/20 0.36
ADAMTS4 O75173 1/20 0.36
F10 P00742 1/20 0.35
HPN P05981 1/20 0.35
PLG P00747 1/20 0.35
ADAMTS5 Q9UNA0 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
CASP3 P42574 1/20 0.35

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
SCHEMBL7363440 0.88 POLB (0.40) F2POLBCTSLCTSSMMP2
SCHEMBL7372723 0.88 MMP2 (0.35) MMP2MMP9
SCHEMBL7375772 0.85 PLAU (0.38) F2POLBPLGALDH1A1MAPT
SCHEMBL7369185 0.80 PLAU (0.36) F2TMPRSS6
SCHEMBL7363430 0.79 PLAU (0.42) POLBALDH1A1MAPT
SCHEMBL7374054 0.79 PLAU (0.38) F2TMPRSS6ALDH1A1
Hydrochloric Acid SCHEMBL7369278 0.77 PLAU (0.36) POLBMMP2MMP9ADAMTS4PLG
SCHEMBL7378754 0.77 PLAU (0.41) ALDH1A1MAPT
SCHEMBL6432944 0.77 F2 (0.42) F2TMPRSS6POLBCTSLCTSS
SCHEMBL7368871 0.76 MMP9 (0.49) MMP2MMP9ADAMTS4PLG

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