SCHEMBL14000191

SCHEMBL14000191

Cc1cccc(C)c1N(CC(=O)Nc1ccc(-c2ccccn2)cc1)C(=O)C1CCS(=O)(=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC6A9 P48067 12/20 0.43
▸ SLC6A5 Q9Y345 1/20 0.42
▸ CTPS1 P17812 1/20 0.39
▸ PORCN Q9H237 1/20 0.39
▸ TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL2238684 0.86 CHRM1 (0.36) —
Amenamevir SCHEMBL2238614 0.82 HDAC1 (0.37) —
SCHEMBL14000159 0.82 MAPT (0.37) —
SCHEMBL2238051 0.79 HDAC1 (0.37) —
SCHEMBL21769567 0.76 HDAC1 (0.38) —
SCHEMBL21769886 0.76 POLB (0.36) —
SCHEMBL21769856 0.75 L3MBTL1 (0.38) —
SCHEMBL2239362 0.74 HDAC1 (0.38) SLC6A9SLC6A5
SCHEMBL2242314 0.74 ALDH1A1 (0.38) —
SCHEMBL2815306 0.74 HTT (0.39) SLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465748-B2 Antiherpesvirus drugs; great pharmacokinetics, good antivirus activity when administered orally at a low dose, high safety profile, less mutagenic concerns; N-(2,6-dimethylphenyl)-N-(2-{[4-(1,3-oxazol-4-yl)phenyl]amino)-2-oxoethyl)tetrahydro-2H-thiopyran-4-carboxamide 1,1-dioxide ASTELLAS PHARMA INC. (JP) 2008-12-16 — — US disclosed
US-7465748-B2 Antiherpesvirus drugs; great pharmacokinetics, good antivirus activity when administered orally at a low dose, high safety profile, less mutagenic concerns; N-(2,6-dimethylphenyl)-N-(2-{[4-(1,3-oxazol-4-yl)phenyl]amino)-2-oxoethyl)tetrahydro-2H-thiopyran-4-carboxamide 1,1-dioxide ASTELLAS PHARMA INC. (JP) 2008-12-16 — — US disclosed
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