SCHEMBL7558762

SCHEMBL7558762

CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc(CCN)cc2)C1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.52
USP30 Q70CQ3 1/20 0.52
CHEK2 O96017 2/20 0.47
PIK3CD O00329 2/20 0.46
ALDH1A1 P00352 1/20 0.46
S1PR3 Q99500 1/20 0.45
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
TPSAB1 Q15661 1/20 0.42
TPSD1 Q9BZJ3 1/20 0.42
TPSG1 Q9NRR2 1/20 0.42

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
SCHEMBL7558767 1.00 GPR119 (0.52) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL3342770 0.93 GPR119 (0.59) GPR119CHEK2ALDH1A1TPSAB1TPSD1
SCHEMBL5089073 0.91 GPR119 (0.54) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL23355604 0.90 GPR119 (0.53) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL28523541 0.90 GPR119 (0.53) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL699609 0.88 GPR119 (0.58) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL699608 0.88 GPR119 (0.58) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL15376614 0.88 GPR119 (0.58) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL15297678 0.86 GPR119 (0.56) GPR119USP30CHEK2PIK3CDALDH1A1
SCHEMBL6925094 0.85 GPR119 (0.53) GPR119USP30CHEK2PIK3CDALDH1A1

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
EP-1174421-A1 3-AMIDINOBENZENESULFONAMIDE DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE SAME AND INTERMEDIATES IN THE PRODUCTION THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2002-01-23 EP disclosed