SCHEMBL16384356

SCHEMBL16384356

CCCCCCCNC(=O)CCSSC

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.65
NAAA Q02083 1/20 0.61
FAAH O00519 5/20 0.53
EPHX2 P34913 3/20 0.53
EPHX1 P07099 5/20 0.50
DNM1 Q05193 2/20 0.50
SLC6A5 Q9Y345 1/20 0.48

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
SCHEMBL17736080 0.93 CASP2 (0.53) CASP2NAAAFAAHEPHX2EPHX1
SCHEMBL9518701 0.91 CASP2 (0.71) CASP2NAAAFAAHEPHX2EPHX1
SCHEMBL1146790 0.91 CASP2 (0.71) CASP2NAAAFAAHEPHX2EPHX1
SCHEMBL9502450 0.91 CASP2 (0.71) CASP2NAAAFAAHEPHX2EPHX1
SCHEMBL9518772 0.89 CASP2 (0.68) CASP2NAAAFAAHEPHX2EPHX1
SCHEMBL2616429 0.88 CASP2 (0.67) CASP2NAAAFAAHEPHX2EPHX1
SCHEMBL25922800 0.86 CASP2 (0.65) CASP2NAAAFAAHEPHX2EPHX1
SCHEMBL4891802 0.86 CASP2 (0.69) CASP2NAAAFAAHEPHX2EPHX1
SCHEMBL10000782 0.85 LMNA (0.43) CASP2NAAAFAAHEPHX2DNM1
SCHEMBL23394708 0.85 CASP2 (0.62) CASP2NAAAFAAHEPHX2EPHX1

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
US-9487775-B2 Method for the synthesis of a bifunctional complex NUEVOLUTION A/S (DK) 2016-11-08 US disclosed
US-9109248-B2 Method for the synthesis of a bifunctional complex NUEVOLUTION A/S (DK) 2015-08-18 US disclosed
US-20150011434-A1 METHOD FOR THE SYNTHESIS OF A BIFUNCTIONAL COMPLEX NUEVOLUTION A/S (DK) 2015-01-08 US disclosed