SCHEMBL7380965

SCHEMBL7380965

NC(=O)C1CCCN1S(=O)(=O)c1ccc2c(NC(N)=NCl)cncc2c1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLAU P00749 5/20 0.53
LMNA P02545 2/20 0.44
HCRTR1 O43613 10/20 0.44
HCRTR2 O43614 10/20 0.44
RECQL P46063 1/20 0.43
TSHR P16473 2/20 0.42
HPN P05981 1/20 0.40

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
SCHEMBL7365364 0.94 PLAU (0.54) PLAULMNAHCRTR1HCRTR2RECQL
Hydrochloric Acid SCHEMBL7368609 0.93 PLAU (0.53) PLAULMNAHCRTR1HCRTR2RECQL
Hydrochloric Acid SCHEMBL7366142 0.93 PLAU (0.53) PLAULMNAHCRTR1HCRTR2RECQL
SCHEMBL7370379 0.91 PLAU (0.54) PLAULMNAHCRTR1HCRTR2RECQL
Hydrochloric Acid SCHEMBL7369946 0.90 PLAU (0.54) PLAULMNAHCRTR1HCRTR2RECQL
Hydrochloric Acid SCHEMBL7369169 0.90 PLAU (0.54) PLAULMNAHCRTR1HCRTR2RECQL
SCHEMBL7368857 0.89 LMNA (0.45) PLAULMNAHCRTR1HCRTR2RECQL
SCHEMBL7371376 0.88 CASP3 (0.50) PLAULMNAHCRTR1HCRTR2RECQL
SCHEMBL7374254 0.88 CASP3 (0.50) PLAULMNAHCRTR1HCRTR2RECQL
Hydrochloric Acid SCHEMBL7378442 0.86 PLAU (0.54) PLAULMNAHCRTR1HCRTR2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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