SCHEMBL8898115

SCHEMBL8898115

CCCCCCCCCCCCCCCC(=O)C(CO)(NCCO)C(=O)CCCCCCCCCCCCCCC

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 8/20 0.47
▸ CES1 P23141 5/20 0.47
▸ CES2 O00748 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ NAAA Q02083 1/20 0.43
▸ SELP P16109 1/20 0.42
▸ CNR1 P21554 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ TRPV1 Q8NER1 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ TDP1 Q9NUW8 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
SCHEMBL115275 0.90 FAAH (0.47) FAAHCES1CES2MEN1KMT2A
SCHEMBL114406 0.81 FAAH (0.46) FAAHCES1CES2MEN1KMT2A
SCHEMBL29174059 0.80 FAAH (0.52) FAAHCES1CES2MEN1KMT2A
SCHEMBL28988028 0.80 FAAH (0.52) FAAHCES1CES2MEN1KMT2A
SCHEMBL23040949 0.79 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL29174024 0.79 FAAH (0.50) FAAHCES1CES2MEN1KMT2A
SCHEMBL29373613 0.77 FAAH (0.48) FAAHCES1CES2MEN1KMT2A
SCHEMBL30203250 0.77 FAAH (0.48) FAAHCES1CES2MEN1KMT2A
SCHEMBL7159921 0.74 FAAH (0.57) FAAHCES1CES2MEN1KMT2A
SCHEMBL6812418 0.74 FAAH (0.57) FAAHCES1CES2MEN1KMT2A

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-0730405-A4 AMPHIPHILIC DERIVATIVES OF GUANIDINE MEGABIOS CORP (US) 1997-02-19 — — EP disclosed
EP-0730405-A1 AMPHIPHILIC DERIVATIVES OF GUANIDINE MEGABIOS CORPORATION (US) 1996-09-11 — — EP disclosed
WO-1995014381-A1 AMPHIPHILIC DERIVATIVES OF GUANIDINE MEGABIOS CORPORATION (US) 1995-06-01 — — WO disclosed
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