SCHEMBL5820358

SCHEMBL5820358

N=C1NC(=O)C(C[C]=O)S1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL2305298 0.79 TSHR (0.53) MAOBKDM4ETSHRHTT
SCHEMBL13547513 0.75 — —
SCHEMBL1520824 0.67 MAOB (1.00) MAOBKDM4E
SCHEMBL18232047 0.62 MAOB (0.50) MAOBTSHRHTT
SCHEMBL15427287 0.57 — —
SCHEMBL11219844 0.56 — —
SCHEMBL599392 0.55 TSHR (0.39) TSHR
SCHEMBL8811471 0.55 TSHR (0.48) MAOBKDM4ETSHRHTT
SCHEMBL10547141 0.54 MAP3K14 (0.41) —
SCHEMBL16924077 0.52 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006093518-A2 THIENYL COMPOUNDS FOR TREATING VIRUS-RELATED CONDITIONS APATH, LLC (US) 2006-09-08 — — WO disclosed
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