SCHEMBL7374254

SCHEMBL7374254

CC(C)(C)OC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c(NC(N)=NCl)cncc2c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 2/20 0.50
HCRTR1 O43613 11/20 0.42
HCRTR2 O43614 11/20 0.42
PLAU P00749 4/20 0.42
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL7371376 1.00 CASP3 (0.50) CASP3HCRTR1HCRTR2PLAULMNA
SCHEMBL7372575 0.92 CASP3 (0.50) CASP3HCRTR1HCRTR2PLAULMNA
SCHEMBL7380965 0.88 PLAU (0.53) HCRTR1HCRTR2PLAULMNARECQL
SCHEMBL7365364 0.87 PLAU (0.54) HCRTR1HCRTR2PLAULMNARECQL
Hydrochloric Acid SCHEMBL7368609 0.87 PLAU (0.53) HCRTR1HCRTR2PLAULMNARECQL
Hydrochloric Acid SCHEMBL7366142 0.87 PLAU (0.53) HCRTR1HCRTR2PLAULMNARECQL
SCHEMBL7370379 0.85 PLAU (0.54) HCRTR1HCRTR2PLAULMNARECQL
Hydrochloric Acid SCHEMBL7369169 0.84 PLAU (0.54) HCRTR1HCRTR2PLAULMNARECQL
Hydrochloric Acid SCHEMBL7369946 0.84 PLAU (0.54) HCRTR1HCRTR2PLAULMNARECQL
SCHEMBL7368857 0.83 LMNA (0.45) HCRTR1HCRTR2PLAULMNARECQL

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