SCHEMBL11128074

SCHEMBL11128074

CCn1c(-c2ccccc2)c(-c2ccccc2)n(CCCCCCCCCCC(=O)OC)c1=O

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 6/20 0.61
▸ TP53 P04637 2/20 0.50
▸ LMNA P02545 3/20 0.43
▸ LTB4R Q15722 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ GAA P10253 2/20 0.41
▸ PTGIR P43119 2/20 0.41
▸ KAT2B Q92831 1/20 0.41
▸ TNF P01375 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ HPGD P15428 1/20 0.39
▸ HTT P42858 1/20 0.39

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
SCHEMBL11124380 0.89 FAAH (0.60) FAAHTP53LMNALTB4RKDM4E
SCHEMBL11120957 0.87 PTGIR (0.53) FAAHPTGIR
SCHEMBL11125751 0.87 PTGIR (0.53) FAAHPTGIR
SCHEMBL11127880 0.85 FAAH (0.56) FAAHTP53LMNALTB4RKDM4E
SCHEMBL11514227 0.80 KDM4E (0.54) FAAHTP53KDM4EMEN1ALDH1A1
SCHEMBL11516177 0.80 KDM4E (0.54) FAAHTP53KDM4EMEN1ALDH1A1
SCHEMBL8104091 0.79 FAAH (0.62) FAAHKDM4EALDH1A1GAATNF
SCHEMBL11134620 0.78 CNR2 (0.53) FAAHKDM4EMEN1ALDH1A1KMT2A
SCHEMBL5720289 0.76 FAAH (0.59) FAAHGAATNF
SCHEMBL8113970 0.76 FAAH (0.76) FAAHTP53MEN1KMT2A

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-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
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