SCHEMBL11123799

SCHEMBL11123799

Cn1cc(-c2ccccc2)n(CCCCCCCC(=O)O)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 4/20 0.50
FABP4 P15090 2/20 0.49
FABP5 Q01469 2/20 0.49
MEN1 O00255 1/20 0.48
GLA P06280 1/20 0.48
KMT2A Q03164 1/20 0.48
TP53 P04637 1/20 0.46
TBXAS1 P24557 2/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PTGER1 P34995 1/20 0.42
PTGER4 P35408 1/20 0.42
PTGER3 P43115 1/20 0.42
PTGS1 P23219 4/20 0.42
PTGS2 P35354 4/20 0.42
NPSR1 Q6W5P4 1/20 0.41
CCNT1 O60563 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
CDK9 P50750 1/20 0.41

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
SCHEMBL11126617 0.76 PTGIR (0.44) PTGIRFABP4FABP5MEN1KMT2A
SCHEMBL11258884 0.76 FABP4 (0.54) PTGIRFABP4FABP5MEN1GLA
SCHEMBL11255916 0.76 FABP4 (0.54) PTGIRFABP4FABP5MEN1GLA
SCHEMBL11267074 0.76 FABP4 (0.54) PTGIRFABP4FABP5MEN1GLA
SCHEMBL11255610 0.76 FABP4 (0.54) PTGIRFABP4FABP5MEN1GLA
SCHEMBL8114438 0.76 PTGIR (0.54) PTGIRFABP4FABP5TBXAS1PTGS1
SCHEMBL11123285 0.76 PTGIR (0.54) PTGIRFABP4FABP5TBXAS1PTGS1
SCHEMBL11125777 0.75 FABP4 (0.52) PTGIRFABP4FABP5MEN1GLA
SCHEMBL11125751 0.75 PTGIR (0.53) PTGIRFABP4FABP5TBXAS1
SCHEMBL11120957 0.75 PTGIR (0.53) PTGIRFABP4FABP5TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0051829-B1 N-SUBSTITUTED OMEGA-(2-OXO-4-IMIDAZOLIN-1-YL) ALCANOIC ACIDS, SALTS AND ESTERS THEREOF, PROCESS FOR PRODUCING THE SAME AND THESE ACTIVE AGENTS CONTAINING PHARMACEUTICAL COMPOUNDS A. Nattermann & Cie. GmbH (DE) 1984-12-05 EP claimed
US-4349684-A ANTIALLERGENS, ANTIASTHMATICS A. NATTERMANN & CIE GMBH (DE) 1982-09-14 US claimed
EP-0051829-A1 N-substituted omega-(2-oxo-4-imidazolin-1-yl) alcanoic acids, salts and esters thereof, process for producing the same and these active agents containing pharmaceutical compounds A. Nattermann & Cie. GmbH (DE) 1982-05-19 EP claimed
EP-0051829-B1 N-SUBSTITUTED OMEGA-(2-OXO-4-IMIDAZOLIN-1-YL) ALCANOIC ACIDS, SALTS AND ESTERS THEREOF, PROCESS FOR PRODUCING THE SAME AND THESE ACTIVE AGENTS CONTAINING PHARMACEUTICAL COMPOUNDS A. Nattermann & Cie. GmbH (DE) 1984-12-05 EP disclosed
US-4349684-A ANTIALLERGENS, ANTIASTHMATICS A. NATTERMANN & CIE GMBH (DE) 1982-09-14 US disclosed
EP-0051829-A1 N-substituted omega-(2-oxo-4-imidazolin-1-yl) alcanoic acids, salts and esters thereof, process for producing the same and these active agents containing pharmaceutical compounds A. Nattermann & Cie. GmbH (DE) 1982-05-19 EP disclosed