SCHEMBL8358497

SCHEMBL8358497

CCOC(=O)Cc1csc(NC(=O)CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.56
▸ POLB P06746 4/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ MAPT P10636 3/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ ESR2 Q92731 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ HTT P42858 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ TSHR P16473 1/20 0.49

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
SCHEMBL8357958 0.90 MAPT (0.51) GAAPOLBSMN1; SMN2MAPTMEN1
SCHEMBL8353674 0.90 MAPT (0.61) GAAPOLBSMN1; SMN2MAPTMEN1
SCHEMBL8350476 0.88 ALDH1A1 (0.63) GAAPOLBMAPTMEN1KMT2A
Acetic Acid SCHEMBL8508080 0.87 MAPT (0.59) GAAPOLBSMN1; SMN2MAPTMEN1
SCHEMBL8350094 0.86 POLB (0.59) GAAPOLBMAPTMEN1KMT2A
SCHEMBL8353740 0.85 ALDH1A1 (0.53) GAAPOLBSMN1; SMN2MAPTMEN1
SCHEMBL8351239 0.85 MAPK1 (0.63) SMN1; SMN2MAPTMEN1KMT2ALMNA
SCHEMBL8350048 0.85 SMN1; SMN2 (0.59) GAAPOLBSMN1; SMN2MAPTMEN1
SCHEMBL8350533 0.84 POLB (0.57) GAAPOLBSMN1; SMN2MAPTMEN1
SCHEMBL8357900 0.83 MAPT (0.55) GAAPOLBMAPTMEN1KMT2A

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
WO-1999031096-A1 PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS SHAMAN PHARMACEUTICALS, INC. (US) 1999-06-24 — — WO claimed
WO-1999031096-A1 PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS SHAMAN PHARMACEUTICALS, INC. (US) 1999-06-24 — — WO disclosed
Send feedback