SCHEMBL13614819

SCHEMBL13614819

CCNC(=O)CCCCCCCCCCN

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.69
SLC6A5 Q9Y345 3/20 0.56
PAOX Q6QHF9 3/20 0.52
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
PLG P00747 1/20 0.48
LMNA P02545 1/20 0.48
THRB P10828 1/20 0.48
ALOX15 P16050 1/20 0.48
SLC6A2 P23975 1/20 0.48
RECQL P46063 1/20 0.48
SLC6A3 Q01959 1/20 0.48
KMT2A Q03164 1/20 0.48
GAA P10253 1/20 0.46
CYP2D6 P10635 1/20 0.44
NFKB1 P19838 1/20 0.44
CYP3A4 P08684 1/20 0.44
EPHX2 P34913 1/20 0.44
MMP2 P08253 1/20 0.44

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
SCHEMBL2968023 1.00 FAAH (0.69) FAAHSLC6A5PAOXMEN1ALDH1A1
SCHEMBL5768333 0.98 FAAH (0.65) FAAHSLC6A5PAOXMEN1ALDH1A1
SCHEMBL7444824 0.91
SCHEMBL13268369 0.89 FAAH (0.86) FAAHMEN1RECQLKMT2AGAA
SCHEMBL10064157 0.89 FAAH (0.86) FAAHMEN1RECQLKMT2AGAA
SCHEMBL9618659 0.86 FAAH (0.81) FAAHMEN1ALDH1A1RECQLKMT2A
SCHEMBL29622817 0.84 FAAH (0.72) FAAHSLC6A5MEN1RECQLKMT2A
SCHEMBL6683810 0.84 FAAH (0.72) FAAHSLC6A5MEN1RECQLKMT2A
SCHEMBL29637719 0.84 FAAH (0.72) FAAHSLC6A5MEN1RECQLKMT2A
SCHEMBL29637710 0.84 FAAH (0.72) FAAHSLC6A5MEN1RECQLKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1432700-B1 SPIRO-HYDANTOIN COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS BRISTOL MYERS SQUIBB CO (US) 2009-11-04 EP disclosed