SCHEMBL8867597

SCHEMBL8867597

Cc1nc(-c2ccc(OCC(C)(C)C)c(C#N)c2)sc1C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 12/20 0.74
▸ ABCC4 O15439 1/20 0.74
▸ ABCB11 O95342 1/20 0.74
▸ PGR P06401 1/20 0.74
▸ CHRM1 P11229 1/20 0.74
▸ PDE4A P27815 1/20 0.74
▸ BLVRB P30043 1/20 0.74
▸ TARBP2 Q15633 1/20 0.74
▸ HDAC6 Q9UBN7 1/20 0.74
▸ ABCG2 Q9UNQ0 1/20 0.74
▸ PPID Q08752 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ RAB9A P51151 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
SCHEMBL439998 0.93 XDH (0.73) XDHABCC4ABCB11PGRCHRM1
SCHEMBL462420 0.91 XDH (0.71) XDHABCC4ABCB11PGRCHRM1
SCHEMBL5136686 0.88 XDH (0.67) XDHABCC4ABCB11PGRCHRM1
SCHEMBL19523341 0.88 XDH (0.79) XDHABCC4ABCB11PGRCHRM1
SCHEMBL27895928 0.86 XDH (0.76) XDHABCC4ABCB11PGRCHRM1
SCHEMBL30253977 0.86 XDH (0.76) XDHABCC4ABCB11PGRCHRM1
SCHEMBL15009105 0.86 XDH (0.73) XDHABCC4ABCB11PGRCHRM1
SCHEMBL23417559 0.85 XDH (0.85) XDHABCC4ABCB11PGRCHRM1
SCHEMBL29183564 0.85 XDH (0.74) XDHABCC4ABCB11PGRCHRM1
SCHEMBL29460288 0.85 XDH (0.74) XDHABCC4ABCB11PGRCHRM1

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-5614520-A 2-arylthiazole derivatives and pharmaceutical composition thereof TEIJIN LIMITED (JP) 1997-03-25 — — US disclosed
EP-0513379-B1 2-ARYLTHIAZOLE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LTD (JP) 1996-09-11 — — EP disclosed
EP-0513379-A1 2-ARYLTHIAZOLE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME TEIJIN LIMITED (JP) 1992-11-19 — — EP disclosed
Send feedback