SCHEMBL7144769

SCHEMBL7144769

CC(C)c1cc(-c2ccsc2)cc(C(C)C)c1N=C=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.36
HTR6 P50406 1/20 0.36
CYP2A6 P11509 4/20 0.35
PTPRC P08575 1/20 0.35
CYP2E1 P05181 1/20 0.34
CYP2B6 P20813 1/20 0.34
ERN1 O75460 3/20 0.33
GRIA4 P48058 2/20 0.33
KCNH2 Q12809 1/20 0.33
P2RY14 Q15391 1/20 0.33
GRIA2 P42262 1/20 0.33
GLO1 Q04760 1/20 0.32
ACMSD Q8TDX5 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
GAK O14976 1/20 0.32

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
SCHEMBL221941 0.83 CA1 (0.43) CA1CA2
SCHEMBL7167416 0.78 GABRA1 (0.38) CA1CA2
SCHEMBL7142114 0.75 HDAC1 (0.36) CYP2A6CYP2E1CYP2B6ERN1KCNH2
SCHEMBL661595 0.71 CYP3A4 (0.37)
SCHEMBL16779903 0.71 GABRA1 (0.35)
SCHEMBL3675026 0.71 FABP4 (0.44)
SCHEMBL7145360 0.71 GABRA1 (0.48)
SCHEMBL6866102 0.70 GABRA1 (0.47)
SCHEMBL20635011 0.70 GABRA1 (0.34)
SCHEMBL191769 0.69 GABRA1 (0.50) CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0964849-B1 SULFONYL UREA DERIVATIVES AND THEIR USE IN THE CONTROL OF INTERLEUKIN-1 ACTIVITY PFIZER (US) 2003-06-04 EP disclosed
EP-1270554-A1 Sulfonyl urea derivatives and their use in the control of interleukin-1 activity PFIZER INC. (US) 2003-01-02 EP disclosed
EP-1270565-A1 4-Substituted furan-2-sulfonamide and its use in the preparation of sulfonyl urea derivatives PFIZER INC. (US) 2003-01-02 EP disclosed
US-6433009-B1 TREATMENT OF AUTOIMMUNE, CARDIOVASCULAR, NERVOUS SYSTEM, GASTROINTESTINAL, RESPIRATORY SYSTEM, AND VIRAL DISORDERS; ANTIDIABETIC, ANTIARTHRITIC, ANTIINFLAMMATORY AND ANTIDEPRESSANT AGENTS PFIZER INC 2002-08-13 US disclosed
EP-1214087-A1 COMBINATION TREATMENT WITH IL-1RA AND COMPOUNDS THAT INHIBIT IL-1 PROCESSING AND RELEASE Pfizer Products Inc. (US) 2002-06-19 EP disclosed
WO-2001019390-A1 COMBINATION TREATMENT WITH IL-1RA AND DIARYL SULPHONYL UREA COMPOUNDS PFIZER PRODUCTS INC. (US) 2001-03-22 WO disclosed