SCHEMBL8358322

SCHEMBL8358322

COC(=O)c1sccc1NC(=O)CN1CCN(c2ccccc2F)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 7/20 0.71
▸ LMNA P02545 4/20 0.71
▸ MAPT P10636 3/20 0.71
▸ HSD17B10 Q99714 2/20 0.71
▸ MAPK1 P28482 2/20 0.71
▸ MAPK10 P53779 1/20 0.71
▸ KMT2A Q03164 4/20 0.66
▸ NPSR1 Q6W5P4 3/20 0.66
▸ CYP1A2 P05177 3/20 0.66
▸ CYP2C9 P11712 3/20 0.66
▸ CYP2C19 P33261 3/20 0.66
▸ MEN1 O00255 3/20 0.66
▸ ALDH1A1 P00352 9/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ CYP3A4 P08684 2/20 0.58
▸ GFER P55789 1/20 0.58
▸ HTR1A P08908 1/20 0.57
▸ HTR7 P34969 1/20 0.57
▸ GAA P10253 2/20 0.57
▸ L3MBTL1 Q9Y468 2/20 0.57

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
SCHEMBL8358036 0.81 POLB (0.72) TSHRLMNAMAPTHSD17B10MAPK1
SCHEMBL31531433 0.80 MAPK10 (0.69) TSHRLMNAMAPTHSD17B10MAPK1
SCHEMBL8350338 0.79 MAPT (0.55) TSHRLMNAMAPTHSD17B10MAPK1
SCHEMBL8351821 0.79 MAPK10 (0.56) TSHRLMNAMAPTHSD17B10MAPK1
SCHEMBL8356499 0.78 MAPK1 (0.61) TSHRLMNAMAPTHSD17B10MAPK1
SCHEMBL8354074 0.78 MAPT (0.68) TSHRLMNAMAPTHSD17B10MAPK1
Hydrochloric Acid SCHEMBL8351225 0.77 MAPT (0.67) TSHRLMNAMAPTHSD17B10MAPK1
SCHEMBL8350342 0.76 MAPT (0.68) TSHRLMNAMAPTHSD17B10MAPK1
SCHEMBL8351326 0.75 MAPT (0.62) TSHRLMNAMAPTHSD17B10MAPK1
SCHEMBL8354036 0.74 MAPK10 (0.51) TSHRLMNAMAPTHSD17B10MAPK1

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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