SCHEMBL8620923

SCHEMBL8620923

CCCCCCS(=O)(=O)Nc1cccc2c(NC(=N)NC=O)cc(-c3ccccc3)nc12

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.38
FEN1 P39748 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
SCHEMBL8619728 0.85 KEAP1 (0.43)
SCHEMBL8613506 0.83 ALDH1A1 (0.45)
SCHEMBL8620939 0.83 ADORA1 (0.47)
SCHEMBL8615672 0.83 MOK (0.38)
SCHEMBL8615114 0.82 ACP1 (0.36)
SCHEMBL8615265 0.82 MRGPRX1 (0.37)
SCHEMBL8614752 0.82 ACP1 (0.36) ALOX5APFEN1
SCHEMBL8618998 0.79 ABCB1 (0.47)
SCHEMBL8615872 0.78 TACR3 (0.38)
SCHEMBL8620920 0.78 TACR3 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0726254-B1 Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds MITSUI TOATSU CHEMICALS (JP) 1998-05-06 EP disclosed
US-5627193-A MEDICAL DIAGNOSIS, CARDIOVASCULAR DIAORDERS AND PROTECTION OF ORGANS FOR TRANSPLANTATION MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-06 US disclosed
EP-0726254-A1 Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-08-14 EP disclosed