SCHEMBL16093045

SCHEMBL16093045

CCNC(=O)CCCS(=O)(=O)NC(=O)CCCCCCCCCCCCCCCc1nnc[nH]1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.38
ITGB3 P05106 1/20 0.33
ITGAV P06756 1/20 0.33
PPARG P37231 2/20 0.33
STS P08842 2/20 0.33
MPO P05164 1/20 0.33
TBXAS1 P24557 2/20 0.33
HSD17B10 Q99714 2/20 0.31
TRPV1 Q8NER1 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
MTNR1A P48039 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL16093442 0.97 FAAH (0.36) FAAHITGB3ITGAVPPARGSTS
SCHEMBL12267044 0.87 TBXAS1 (0.46) TBXAS1MAPTALDH1A1
SCHEMBL1688321 0.82 FAAH (0.38) FAAHITGB3ITGAVPPARG
SCHEMBL13260587 0.78 TRPV1 (0.44) FAAHSTSHSD17B10TRPV1MEN1
SCHEMBL16093430 0.77 FAAH (0.34) FAAHPPARGMPOKDM4EALDH1A1
SCHEMBL13880533 0.76 FAAH (0.39) FAAHITGB3ITGAVPPARG
SCHEMBL12809270 0.73 FAAH (0.34) FAAHPPARGSTSHSD17B10TRPV1
SCHEMBL13226753 0.73 ALDH1A1 (0.32) FAAHPPARGSTSMEN1KMT2A
SCHEMBL13892164 0.73 FAAH (0.38) FAAHSTSHSD17B10ALDH1A1
SCHEMBL13113625 0.72 CASP2 (0.40) FAAHSTSALDH1A1HPGD

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
US-8841249-B2 Growth hormones with prolonged in-vivo efficacy NOVO NORDISK A/S (DK) 2014-09-23 US disclosed