SCHEMBL10906624

SCHEMBL10906624

C=CCNC(=S)N(C(C)C(C)C(=O)O)N(C)C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.38
▸ ALDH1A1 P00352 4/20 0.36
▸ ATM Q13315 1/20 0.35
▸ TSHR P16473 2/20 0.34
▸ ALPL P05186 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HTT P42858 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ LMNA P02545 1/20 0.32

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
SCHEMBL10903597 0.78 GAA (0.35) GAAALDH1A1ATMTSHRALPL
SCHEMBL10906622 0.71 GAA (0.36) GAAALDH1A1ATMTSHRALPL
SCHEMBL9555565 0.68 — —
SCHEMBL22769175 0.68 ALDH1A1 (0.50) GAAALDH1A1TSHRL3MBTL1MAPT
SCHEMBL10906183 0.67 MAPT (0.40) GAAALDH1A1TSHRL3MBTL1MAPT
SCHEMBL10906623 0.66 GAA (0.37) GAAALDH1A1TSHRL3MBTL1HTT
SCHEMBL10903598 0.66 TSHR (0.42) GAAALDH1A1TSHRMAPTSMN1; SMN2
SCHEMBL10905414 0.64 — —
SCHEMBL3459597 0.64 HPGD (0.44) ALDH1A1ATMTSHRALPLHTT
SCHEMBL28246202 0.64 ALDH1A1 (0.36) ALDH1A1ATMTSHRMAPTSMN1; SMN2

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-4633014-A ANTIARRHYTHMIA AGENTS INSTITUT ORGANICHESKOGO SINTEZA AKADEMII NAUK LATVIISKOI SSR 1986-12-30 — — US disclosed
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