SCHEMBL10906622

SCHEMBL10906622

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

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.36
▸ ALPL P05186 1/20 0.35
▸ ALDH1A1 P00352 5/20 0.34
▸ ATM Q13315 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ TSHR P16473 2/20 0.33
▸ USP2 O75604 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31

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
SCHEMBL10906183 0.74 MAPT (0.40) GAAALDH1A1MAPTSMN1; SMN2FAAH
SCHEMBL10906623 0.72 GAA (0.37) GAAALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL10903598 0.72 TSHR (0.42) GAAALDH1A1MAPTSMN1; SMN2FAAH
SCHEMBL10906624 0.71 GAA (0.38) GAAALPLALDH1A1ATMMAPT
SCHEMBL5892318 0.68 MAPK1 (0.48) ATMMAPTSMN1; SMN2HTTKMT2A
SCHEMBL10903591 0.68 SLC1A3 (0.44) KMT2ATSHRUSP2
SCHEMBL28162306 0.67 CA2 (0.41) ALDH1A1MAPTKMT2AFAAHTSHR
SCHEMBL10906616 0.67 ALDH1A1 (0.37) GAAALDH1A1HPGDKMT2ATSHR
SCHEMBL9555565 0.66 — —
SCHEMBL22769175 0.66 ALDH1A1 (0.50) GAAALDH1A1MAPTSMN1; SMN2KMT2A

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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