SCHEMBL7951029

SCHEMBL7951029

NC(Cc1ccccc1)C(O)C(=O)NCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 4/20 0.68
ANPEP P15144 2/20 0.68
RNPEP Q9H4A4 1/20 0.68
DNPEP Q9ULA0 1/20 0.68
MMP8 P22894 1/20 0.56
ALDH1A1 P00352 1/20 0.51
CYP3A4 P08684 1/20 0.51
BACE1 P56817 1/20 0.49
BACE2 Q9Y5Z0 1/20 0.49
LTA4H P09960 1/20 0.49
KMT2A Q03164 1/20 0.49
SLC15A1 P46059 1/20 0.49

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
SCHEMBL17097365 1.00 LAP3 (0.68) LAP3ANPEPRNPEPDNPEPMMP8
Hydrochloric Acid SCHEMBL17595507 0.98 LAP3 (0.66) LAP3ANPEPRNPEPDNPEPMMP8
Trifluoroacetic Acid SCHEMBL17106970 0.93 LAP3 (0.60) LAP3ANPEPRNPEPDNPEPMMP8
Trifluoroacetic Acid SCHEMBL17106974 0.93 LAP3 (0.60) LAP3ANPEPRNPEPDNPEPMMP8
SCHEMBL20474481 0.86 LAP3 (0.70) LAP3ANPEPRNPEPDNPEPCYP3A4
SCHEMBL8494993 0.86 LAP3 (0.70) LAP3ANPEPRNPEPDNPEPCYP3A4
SCHEMBL5414776 0.86 LAP3 (0.55) LAP3ANPEPRNPEPDNPEPMMP8
SCHEMBL6631129 0.86 LAP3 (0.55) LAP3ANPEPRNPEPDNPEPMMP8
SCHEMBL7436307 0.86 LAP3 (0.66) LAP3ANPEPRNPEPDNPEPALDH1A1
SCHEMBL3612410 0.86 LAP3 (0.55) LAP3ANPEPRNPEPDNPEPMMP8

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
US-6271238-B1 USEFUL IN TREATING AND PREVENTING DISEASES INVOLVING CHYMOTRYPSIN TYPE PROTEASES WHICH ARE RELATED TO ASTHMA, ALLERGY, INFLAMMATIONS, RHEUMATISM, HYPERTENSION, HEART FAILURE, MYOCARDIAL INFARCTION, AND CARDIAC HYPERTROPHY NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-08-07 US disclosed
EP-0936216-A1 NOVEL ACETAMIDE DERIVATIVES AND PROTEASE INHIBITORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1999-08-18 EP disclosed