SCHEMBL8356273

SCHEMBL8356273

CCCOC(=O)Cc1csc(NC(=O)CN2CCN(c3cccc(C(F)(F)F)c3)CC2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.54
▸ ALDH1A1 P00352 4/20 0.54
▸ LMNA P02545 4/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ POLB P06746 3/20 0.54
▸ MAPK1 P28482 1/20 0.48
▸ PDE5A O76074 1/20 0.47
▸ HTR2A P28223 2/20 0.47
▸ HTR2C P28335 1/20 0.47
▸ SLC6A4 P31645 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ MMP2 P08253 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL8353638 0.95 MAPT (0.52) MAPTALDH1A1LMNAKDM4EPOLB
SCHEMBL8357900 0.94 MAPT (0.55) MAPTALDH1A1LMNAKDM4EPOLB
SCHEMBL8350635 0.91 MAPT (0.58) MAPTALDH1A1LMNAKDM4EPOLB
SCHEMBL8358090 0.88 MAPT (0.54) MAPTALDH1A1LMNAKDM4EPOLB
SCHEMBL8353194 0.87 ALDH1A1 (0.61) MAPTALDH1A1LMNAKDM4EPOLB
SCHEMBL8351254 0.85 GAA (0.53) MAPTALDH1A1LMNAPOLBMAPK1
Glyoxylate SCHEMBL8513757 0.84 MAPT (0.57) MAPTALDH1A1LMNAKDM4EPOLB
SCHEMBL8350533 0.83 POLB (0.57) MAPTALDH1A1LMNAPOLBGAA
SCHEMBL8354260 0.82 TP53 (0.54) MAPTALDH1A1POLBMAPK1GAA
SCHEMBL8353674 0.82 MAPT (0.61) MAPTALDH1A1LMNAKDM4EPOLB

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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