SCHEMBL7147972

SCHEMBL7147972

CCCCCNC(=O)SC(N)=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 11/20 0.52
CASP2 P42575 1/20 0.47
DPP7 Q9UHL4 2/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
NAAA Q02083 1/20 0.44
SPHK1 Q9NYA1 3/20 0.42
RRM1 P23921 1/20 0.42

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
SCHEMBL3085340 0.78 EPHX1 (0.44) EPHX1SPHK1
SCHEMBL22625346 0.78 EPHX1 (0.59) EPHX1CASP2DPP7ZDHHC20ZDHHC2
SCHEMBL10784050 0.77 EPHX1 (0.58) EPHX1CASP2DPP7ZDHHC20ZDHHC2
SCHEMBL8007143 0.76 EPHX1 (0.62) EPHX1CASP2DPP7ZDHHC20ZDHHC2
SCHEMBL28947 0.76
SCHEMBL10784886 0.75 EPHX1 (0.56) EPHX1CASP2DPP7ZDHHC20ZDHHC2
SCHEMBL10963060 0.75 EPHX1 (0.61) EPHX1CASP2ZDHHC20ZDHHC2NAAA
SCHEMBL76613 0.74 EPHX1 (0.67) EPHX1CASP2DPP7ZDHHC20ZDHHC2
SCHEMBL19468457 0.74 EPHX1 (0.67) EPHX1CASP2DPP7ZDHHC20ZDHHC2
SCHEMBL3055110 0.74 EPHX1 (0.67) EPHX1CASP2DPP7ZDHHC20ZDHHC2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828488-B1 ISOTHIAZOLONES WARNER LAMBERT CO (US) 2003-02-12 EP disclosed
US-6133270-A Isothiazolones and pharmaceutical formulations WARNER-LAMBERT COMPANY (US) 2000-10-17 US disclosed
US-6001863-A USEFUL AS ANTIVIRAL, ANTIINFLAMMATORY AND ANTIATHEROSCLEROSIS AGENT; ADMINISTERING TO THE PATIENT IN NEED OF ZINC EJECTION FROM NUCLEOCAPSID PROTEIN WARNER-LAMBERT COMPANY (US) 1999-12-14 US disclosed
US-5889034-A ANTIINFLAMMATORY AGENT; ANTIATHEROSCLEROSIS AGENT; VIRICIDES WARNER-LAMBERT COMPANY (US) 1999-03-30 US disclosed
US-5733921-A ANTIRETROVIRAL AGENTS; ANTIINFLAMMATORY AGENTS; ANTIATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1998-03-31 US disclosed
EP-0828488-A1 ISOTHIAZOLONES WARNER-LAMBERT COMPANY (US) 1998-03-18 EP disclosed
US-5668162-A Isothiazolones lower plasma levels of lipoprotein(a) WARNER-LAMBERT COMPANY 1997-09-16 US disclosed
US-5620997-A VIRICIDES, ANTIINFLAMMATORY AGENTS, ANTIATHEROSCLEROTIC AGENT WARNER-LAMBERT COMPANY (US) 1997-04-15 US disclosed
WO-1996038144-A1 ISOTHIAZOLONES WARNER-LAMBERT COMPANY (US) 1996-12-05 WO disclosed