SCHEMBL13824167

SCHEMBL13824167

CC#Cc1cn(C(C)C)c(=S)[nH]c1=O

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ HCRTR1 O43613 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 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
SCHEMBL12747285 0.83 MET (0.35) ALDH1A1SMN1; SMN2L3MBTL1GAA
SCHEMBL13350400 0.78 MEN1 (0.32) ALDH1A1MAPT
SCHEMBL8656137 0.74 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHCRTR1
SCHEMBL21418605 0.73 SMN1; SMN2 (0.43) ALDH1A1SMN1; SMN2L3MBTL1KDM4EHCRTR1
SCHEMBL25638707 0.68 SMN1; SMN2 (0.37) ALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL25079934 0.67 — —
SCHEMBL887590 0.67 DAO (0.38) L3MBTL1GAAMAPT
SCHEMBL22327310 0.66 SMN1; SMN2 (0.33) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL26758019 0.66 MET (0.35) ALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL25638690 0.65 SMN1; SMN2 (0.32) ALDH1A1SMN1; SMN2L3MBTL1

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
US-20090163381-A1 Methods, Kits and Compositions Pertaining to Combination Oligomers and Libraries for Their Preparation APPLERA CORPORATION. (US) 2009-06-25 — — US disclosed
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