SCHEMBL8350533

SCHEMBL8350533

CCOC(=O)Cc1csc(NC(=O)CN2CCN(c3ccc(C(F)(F)F)cc3)CC2)n1

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.57
▸ GAA P10253 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ ESR2 Q92731 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ MAPT P10636 2/20 0.50
▸ DEGS1 O15121 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
SCHEMBL8351254 0.91 GAA (0.53) POLBGAAMEN1KMT2AESR2
SCHEMBL8357900 0.90 MAPT (0.55) POLBGAAMEN1KMT2AESR2
SCHEMBL8354260 0.88 TP53 (0.54) POLBGAAALDH1A1MAPT
SCHEMBL8350306 0.88 SMN1; SMN2 (0.53) POLBGAAMEN1KMT2AESR2
SCHEMBL8350094 0.88 POLB (0.59) POLBGAAMEN1KMT2AESR2
SCHEMBL8357958 0.87 MAPT (0.51) POLBGAAMEN1KMT2AESR2
SCHEMBL8358497 0.84 GAA (0.56) POLBGAAMEN1KMT2AESR2
SCHEMBL8350476 0.84 ALDH1A1 (0.63) POLBGAAMEN1KMT2AESR2
SCHEMBL8356273 0.83 MAPT (0.54) POLBGAAMEN1KMT2AL3MBTL1
SCHEMBL8353674 0.82 MAPT (0.61) POLBGAAMEN1KMT2AESR2

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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