SCHEMBL7163016

SCHEMBL7163016

CCCCCCCCCCCCCC(=O)NCCCCCC(CC)CCCCCCCCCCO

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.61
▸ CASP2 P42575 1/20 0.56
▸ DNM1 Q05193 1/20 0.55
▸ CNR1 P21554 4/20 0.55
▸ FAAH O00519 4/20 0.54
▸ EPHX2 P34913 3/20 0.50
▸ SELP P16109 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ TRPV1 Q8NER1 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ BLM P54132 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL7163014 0.88 SELP (0.56) NAAACASP2DNM1CNR1FAAH
SCHEMBL7555064 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH
SCHEMBL11228729 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH
SCHEMBL8616640 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH
SCHEMBL97365 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH
SCHEMBL4971264 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH
SCHEMBL22660864 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH
SCHEMBL21477651 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH
SCHEMBL22660863 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH
SCHEMBL7355704 0.87 NAAA (0.79) NAAACASP2DNM1CNR1FAAH

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-6555372-B1 Viricides and antitumor agents KIRIN BEER KABUSHIKI KAISHA (JP) 2003-04-29 — — US disclosed
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