SCHEMBL8358204

SCHEMBL8358204

COC(=O)Cc1nsc(NC(=O)CN2CCN(c3cccc(C(F)(F)F)c3)CC2)n1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.58
▸ MAPT P10636 7/20 0.58
▸ KDM4E B2RXH2 5/20 0.58
▸ LMNA P02545 5/20 0.58
▸ POLB P06746 4/20 0.58
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ MAPK1 P28482 2/20 0.51
▸ TSHR P16473 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ KDM4C Q9H3R0 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ CETP P11597 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
SCHEMBL8350635 0.84 MAPT (0.58) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL8352629 0.83 MAPT (0.59) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL8356301 0.79 MAPT (0.57) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL8354500 0.78 MAPT (0.61) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL8356307 0.77 MAPT (0.55) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL8357900 0.77 MAPT (0.55) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL8358090 0.77 MAPT (0.54) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL11261037 0.77 MAPT (0.64) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL8353854 0.76 ALDH1A1 (0.66) ALDH1A1MAPTKDM4ELMNAPOLB
SCHEMBL8353724 0.76 ALDH1A1 (0.56) ALDH1A1MAPTKDM4ELMNAPOLB

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 disclosed
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