SCHEMBL11275768

SCHEMBL11275768

N=C(N)NC(=O)Nc1ccc(O)c(O)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PYGL P06737 2/20 0.49
ALOX15 P16050 3/20 0.49
SNCA P37840 1/20 0.45
TOP1 P11387 2/20 0.43
ERCC1 P07992 2/20 0.43
ERCC4 Q92889 2/20 0.43
PIM1 P11309 1/20 0.41
PLAU P00749 3/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
POLH Q9Y253 1/20 0.40
F2 P00734 2/20 0.38
F10 P00742 2/20 0.38
PLAT P00750 2/20 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
SCHEMBL11280226 0.82 TOP1 (0.39) PYGLSNCATOP1PLAU
SCHEMBL14868391 0.82 SNCA (0.40) PYGLALOX15SNCATOP1ERCC1
SCHEMBL11596366 0.81 SNCA (0.44) PYGLALOX15SNCATOP1ERCC1
SCHEMBL109020 0.81 ALOX15 (0.66) PYGLALOX15SNCATOP1ERCC1
SCHEMBL11280533 0.80 PYGL (0.47) PYGLALOX15SNCATOP1ERCC1
Hydrochloric Acid SCHEMBL11594293 0.80 SNCA (0.43) PYGLALOX15SNCATOP1ERCC1
SCHEMBL11133331 0.79 ALOX15 (0.47) ALOX15SNCATOP1ERCC1ERCC4
SCHEMBL6692568 0.79 SNCA (0.49) PYGLALOX15SNCATOP1ERCC1
SCHEMBL11265563 0.79 PYGL (0.46) PYGLALOX15SNCATOP1ERCC1
SCHEMBL9673117 0.78 ALOX15 (0.54) PYGLALOX15SNCATOP1ERCC1

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
US-4326075-A ANTIDIARRHEA AGENTS WILLIAM H. RORER, INC. (US) 1982-04-20 US disclosed
US-4203920-A ANTIDIARRHEAL WILLIAM H. RORER, INC. (US) 1980-05-20 US disclosed
US-4060635-A Amidinoureas for treating diarrhea WILLIAM H. RORER, INC. (US) 1977-11-29 US disclosed