SCHEMBL5497827

SCHEMBL5497827

CCCCCC[C](CCC)C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 3/20 0.47
CYP1A2 P05177 1/20 0.39
SIGMAR1 Q99720 2/20 0.39
EPHX1 P07099 8/20 0.38
EPHX2 P34913 2/20 0.38
CES2 O00748 2/20 0.37
CES1 P23141 2/20 0.37

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
SCHEMBL16702937 0.96 NAAA (0.50) NAAACYP1A2SIGMAR1EPHX1EPHX2
SCHEMBL6024059 0.92 NAAA (0.46) NAAACYP1A2SIGMAR1EPHX1EPHX2
SCHEMBL23501850 0.87 NAAA (0.38) NAAACYP1A2EPHX1CES2CES1
SCHEMBL16703624 0.79 NAAA (0.36) NAAACYP1A2EPHX1CES2CES1
SCHEMBL10959885 0.76 NAAA (0.56) NAAACES2CES1
SCHEMBL10962978 0.76 NAAA (0.56) NAAACES2CES1
SCHEMBL10960947 0.76 NAAA (0.56) NAAACES2CES1
SCHEMBL2126029 0.76 NAAA (0.56) NAAACES2CES1
SCHEMBL2126868 0.76 NAAA (0.56) NAAACES2CES1
SCHEMBL10960790 0.76 NAAA (0.56) NAAACES2CES1

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-1572892-A4 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL MYERS SQUIBB CO (US) 2007-08-22 EP disclosed
EP-1572892-A2 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS Bristol-Myers Squibb Company (US) 2005-09-14 EP disclosed
WO-2003033671-A2 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-04-24 WO disclosed