SCHEMBL7102996

SCHEMBL7102996

CN(C)S(=O)(=O)n1cc(C(CC(=O)O)c2ccnc3ccccc23)nc1[Si](C)(C)C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.31
CASP1 P29466 1/20 0.31
TSHR P16473 1/20 0.31
SLC22A12 Q96S37 1/20 0.30

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
SCHEMBL6213830 0.87 TSHR (0.32) OPRD1TSHR
SCHEMBL6214453 0.83 OPRD1 (0.31) OPRD1
SCHEMBL6212520 0.83 TSHR (0.30) TSHR
SCHEMBL2103475 0.74 TSHR (0.33) TSHR
SCHEMBL6214909 0.72 CCNC (0.33) SLC22A12
SCHEMBL6215881 0.69 CCNC (0.33)
SCHEMBL22075884 0.66 TSHR (0.35) TSHR
SCHEMBL2626833 0.65 IDH1 (0.31)
SCHEMBL16151154 0.63 LOXL2 (0.45) CASP1SLC22A12
SCHEMBL224515 0.63 KDM4E (0.30)

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-0975602-A4 IMIDAZOLE AND IMIDAZOLINE DERIVATIVES AND USES THEREOF GRUENENTHAL GMBH (DE) 2003-01-22 EP disclosed
EP-0975602-A1 IMIDAZOLE AND IMIDAZOLINE DERIVATIVES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-02-02 EP disclosed
WO-1998046572-A1 IMIDAZOLE AND IMIDAZOLINE DERIVATIVES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-10-22 WO disclosed