SCHEMBL8350090

SCHEMBL8350090

COC(=O)CCc1nnc(NC(=O)CN2CCN(c3ccc(OC)cc3)CC2)s1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.67
▸ KMT2A Q03164 5/20 0.62
▸ GFER P55789 1/20 0.56
▸ LMNA P02545 3/20 0.55
▸ MAPT P10636 3/20 0.55
▸ TSHR P16473 3/20 0.55
▸ HTT P42858 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ MEN1 O00255 3/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ REV1 Q9UBZ9 1/20 0.53
▸ DRD4 P21917 1/20 0.52

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
SCHEMBL8357277 0.90 USP2 (0.69) USP2KMT2AGFERLMNAMAPT
SCHEMBL8356301 0.81 MAPT (0.57) USP2KMT2ALMNAMAPTTSHR
SCHEMBL8353727 0.81 ALDH1A1 (0.62) USP2KMT2ALMNAMAPTTSHR
SCHEMBL8354273 0.80 USP2 (0.69) USP2KMT2AGFERLMNAMAPT
SCHEMBL8356307 0.76 MAPT (0.55) USP2KMT2ALMNAMAPTTSHR
SCHEMBL8350371 0.72 SLC27A1 (0.68) KMT2ALMNAALDH1A1MEN1KDM4E
SCHEMBL8352629 0.72 MAPT (0.59) USP2KMT2ALMNAMAPTTSHR
SCHEMBL8351229 0.71 GLS (0.58) LMNAMAPTTSHRSMN1; SMN2ALDH1A1
SCHEMBL8353646 0.71 MEN1 (0.63) USP2KMT2AGFERLMNAMAPT
SCHEMBL15401066 0.71 KDR (0.74) USP2KMT2ALMNAMAPTHTT

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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