SCHEMBL8357277

SCHEMBL8357277

COC(=O)Cc1nnc(NC(=O)CN2CCN(c3ccc(OC)cc3)CC2)s1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.69
▸ KMT2A Q03164 6/20 0.64
▸ GFER P55789 1/20 0.58
▸ MAPT P10636 4/20 0.57
▸ LMNA P02545 3/20 0.57
▸ TSHR P16473 3/20 0.57
▸ HTT P42858 1/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ MAPK1 P28482 2/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ MEN1 O00255 4/20 0.56
▸ KDM4E B2RXH2 1/20 0.55
▸ REV1 Q9UBZ9 1/20 0.55
▸ POLB P06746 1/20 0.53
▸ DRD4 P21917 1/20 0.53

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
SCHEMBL8350090 0.90 USP2 (0.67) USP2KMT2AGFERMAPTLMNA
SCHEMBL8354273 0.82 USP2 (0.69) USP2KMT2AGFERMAPTLMNA
SCHEMBL8352629 0.81 MAPT (0.59) USP2KMT2AMAPTLMNATSHR
SCHEMBL8353646 0.80 MEN1 (0.63) USP2KMT2AGFERMAPTLMNA
SCHEMBL8350371 0.73 SLC27A1 (0.68) KMT2ALMNAALDH1A1MEN1KDM4E
SCHEMBL8353724 0.73 ALDH1A1 (0.56) USP2KMT2AMAPTLMNATSHR
SCHEMBL15401066 0.73 KDR (0.74) USP2KMT2AMAPTLMNAHTT
SCHEMBL977214 0.72 LMNA (0.68) USP2KMT2AGFERMAPTLMNA
SCHEMBL20378701 0.72 GFER (0.67) KMT2AGFERMAPTLMNATSHR
SCHEMBL6269531 0.72 TSHR (0.81) USP2KMT2AGFERMAPTLMNA

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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