SCHEMBL8350645

SCHEMBL8350645

CCOC(=O)Cc1csc(NC(=O)CN2CCN(c3ccc(C(c4ccccc4)c4ccc(Cl)cc4)cc3)CC2)n1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ POLB P06746 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ GAA P10253 2/20 0.50
▸ LMNA P02545 2/20 0.50
▸ DRD4 P21917 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ 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
SCHEMBL8350643 0.90 MAPT (0.50) MAPTSMN1; SMN2POLBKDM4EGAA
SCHEMBL8350094 0.88 POLB (0.59) MAPTPOLBGAALMNAALDH1A1
SCHEMBL8353674 0.84 MAPT (0.61) MAPTSMN1; SMN2POLBKDM4EGAA
Acetic Acid SCHEMBL8508080 0.84 MAPT (0.59) MAPTSMN1; SMN2POLBGAALMNA
SCHEMBL8350476 0.83 ALDH1A1 (0.63) MAPTPOLBGAALMNAALDH1A1
SCHEMBL8358497 0.83 GAA (0.56) MAPTSMN1; SMN2POLBGAALMNA
SCHEMBL8350533 0.81 POLB (0.57) MAPTSMN1; SMN2POLBGAALMNA
SCHEMBL8350048 0.79 SMN1; SMN2 (0.59) MAPTSMN1; SMN2POLBKDM4EGAA
SCHEMBL8353740 0.79 ALDH1A1 (0.53) MAPTSMN1; SMN2POLBGAALMNA
SCHEMBL8351239 0.79 MAPK1 (0.63) MAPTSMN1; SMN2LMNADRD4ALDH1A1

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