SCHEMBL9533596

SCHEMBL9533596

CCCCCCCCCCCCCCCCCCNC(=O)S

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 10/20 0.67
CASP2 P42575 1/20 0.59
NAAA Q02083 3/20 0.55
ZDHHC20 Q5W0Z9 1/20 0.55
ZDHHC2 Q9UIJ5 1/20 0.55
PRCP P42785 1/20 0.52
FAAH O00519 1/20 0.50
PLA2G2A P14555 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
SCHEMBL5933219 1.00 EPHX1 (0.67) EPHX1CASP2NAAAZDHHC20ZDHHC2
SCHEMBL5932722 1.00 EPHX1 (0.67) EPHX1CASP2NAAAZDHHC20ZDHHC2
SCHEMBL690004 1.00 EPHX1 (0.67) EPHX1CASP2NAAAZDHHC20ZDHHC2
SCHEMBL5932682 1.00 EPHX1 (0.67) EPHX1CASP2NAAAZDHHC20ZDHHC2
SCHEMBL9532818 1.00 EPHX1 (0.67) EPHX1CASP2NAAAZDHHC20ZDHHC2
SCHEMBL5932852 1.00 EPHX1 (0.67) EPHX1CASP2NAAAZDHHC20ZDHHC2
SCHEMBL690225 0.98
SCHEMBL687620 0.90
SCHEMBL9615037 0.87 KDM4E (0.52) EPHX1CASP2
SCHEMBL12807564 0.87 KDM4E (0.52) EPHX1CASP2

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
EP-0251827-B1 NEW CYCLIC ETHER DERIVATIVES, THEIR PREPARATION AND THEIR USE Sankyo Company Limited (JP) 1993-09-15 EP disclosed
EP-0251827-A2 New cyclic ether derivatives, their preparation and their use Sankyo Company Limited (JP) 1988-01-07 EP disclosed
US-4399075-A Process for producing chlorinated phenoxytoluene derivatives ASAHI CHEMICAL COMPANY, LIMITED (JP) 1983-08-16 US disclosed