SCHEMBL7370211

SCHEMBL7370211

N=C(N)Nc1ncc(Cl)c2ccc(C(=O)NC(CC(=O)O)C(=O)O)cc12

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.51
CA1 P00915 7/20 0.51
CASP3 P42574 1/20 0.42
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
TMPRSS15 P98073 6/20 0.41
PRSS1 P07477 5/20 0.41
GRN P28799 1/20 0.40
SORT1 Q99523 1/20 0.40
PYGL P06737 1/20 0.38

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
Trifluoroacetic Acid SCHEMBL6434979 0.94 CA2 (0.46) CA2CA1CASP3ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL6434983 0.94 CA2 (0.46) CA2CA1CASP3ITGB3ITGA2B
Trifluoroacetic Acid SCHEMBL6434379 0.85 CA2 (0.46) CA2CA1TMPRSS15GRNSORT1
SCHEMBL7369537 0.85 CTSA (0.46) ITGB3ITGA2B
SCHEMBL7401273 0.84 CA2 (0.55) CA2CA1CASP3TMPRSS15GRN
SCHEMBL7401270 0.84 CA2 (0.55) CA2CA1CASP3TMPRSS15GRN
SCHEMBL6434387 0.83 MRGPRX4 (0.37) CA2CA1TMPRSS15GRNSORT1
Trifluoroacetic Acid SCHEMBL6432685 0.83 CA2 (0.49) CA2CA1
Trifluoroacetic Acid SCHEMBL6435197 0.83 GRN (0.51) CA2CA1ITGB3ITGA2BTMPRSS15
Trifluoroacetic Acid SCHEMBL6432682 0.83 CA2 (0.49) CA2CA1

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