SCHEMBL18890830

SCHEMBL18890830

COC(=O)NCCCCCCNC(=O)CCCCC(N)=O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.56
TSHR P16473 1/20 0.50
CASP2 P42575 1/20 0.47
FAAH O00519 3/20 0.46
SLC6A5 Q9Y345 2/20 0.45
NAAA Q02083 1/20 0.44
RECQL P46063 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
DNM1 Q05193 2/20 0.44
BCHE P06276 1/20 0.43
CHRM2 P08172 1/20 0.43
ACHE P22303 1/20 0.43
EPHX2 P34913 3/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 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
SCHEMBL7771587 0.93 EPHX1 (0.64) EPHX1FAAHMAOAMAOBACHE
SCHEMBL7770941 0.93 EPHX1 (0.64) EPHX1FAAHMAOAMAOBACHE
SCHEMBL7769388 0.91 EPHX1 (0.61) EPHX1TSHRMAOAMAOBACHE
SCHEMBL1940161 0.87 CASP2 (0.54) TSHRCASP2FAAHSLC6A5NAAA
SCHEMBL18264866 0.86 EPHX1 (0.61) EPHX1TSHRCASP2FAAHSLC6A5
SCHEMBL26748536 0.86 EPHX1 (0.56) EPHX1TSHRCASP2FAAHSLC6A5
SCHEMBL7769326 0.85 EPHX1 (0.57) EPHX1TSHRMAOAMAOBACHE
SCHEMBL14086303 0.83 MAOA (0.66) MAOAMAOBMEN1KMT2A
SCHEMBL14305071 0.82 MAOA (0.64) MAOAMAOBMEN1KMT2A
SCHEMBL21782549 0.82 RECQL (0.48) TSHRCASP2FAAHSLC6A5NAAA

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-20170144127-A1 DEPOLYMERIZATION PROCESSES, APPARATUSES AND CATALYSTS FOR USE IN CONNECTION THEREWITH MOHANTY PRAVANSU S (US) 2017-05-25 US disclosed