SCHEMBL8351254

SCHEMBL8351254

CCOC(=O)Cc1csc(NC(=O)CN2CCN(c3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)n1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ POLB P06746 5/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ LMNA P02545 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ ESR2 Q92731 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ MAPT P10636 1/20 0.48

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
SCHEMBL8354260 0.94 TP53 (0.54) GAAALDH1A1POLBMAPK1HTT
SCHEMBL8357900 0.92 MAPT (0.55) GAAALDH1A1POLBMAPK1LMNA
SCHEMBL8350533 0.91 POLB (0.57) GAASMN1; SMN2ALDH1A1POLBLMNA
SCHEMBL8357958 0.85 MAPT (0.51) GAASMN1; SMN2ALDH1A1POLBLMNA
SCHEMBL8356273 0.85 MAPT (0.54) GAAALDH1A1POLBMAPK1LMNA
SCHEMBL8350306 0.85 SMN1; SMN2 (0.53) GAASMN1; SMN2ALDH1A1POLBMAPK1
SCHEMBL8350094 0.84 POLB (0.59) GAAALDH1A1POLBLMNAMEN1
SCHEMBL8353638 0.84 MAPT (0.52) GAAALDH1A1POLBMAPK1LMNA
SCHEMBL8350635 0.83 MAPT (0.58) GAAALDH1A1POLBMAPK1LMNA
SCHEMBL8353674 0.82 MAPT (0.61) GAASMN1; SMN2ALDH1A1POLBLMNA

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
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