SCHEMBL9763142

SCHEMBL9763142

CC(C)(C)OC(=O)N1C(=O)C(CC2(O)CC2)C[C@H]1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TPSAB1 Q15661 1/20 0.32
TPSD1 Q9BZJ3 1/20 0.32
TPSG1 Q9NRR2 1/20 0.32
NR1H2 P55055 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
DPP4 P27487 1/20 0.31
STS P08842 1/20 0.31
KLK7 P49862 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
KDM4E B2RXH2 2/20 0.31
PKM P14618 1/20 0.31
BUB1 O43683 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30

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
SCHEMBL9764001 0.95 DDB1 (0.32) DDB1CRBNHSD17B10TPSAB1TPSD1
SCHEMBL6494880 0.83 KLK7 (0.36) DDB1CRBNHSD17B10TPSAB1TPSD1
SCHEMBL3394051 0.81 DDB1 (0.34) DDB1CRBNHSD17B10TPSAB1TPSD1
SCHEMBL7698258 0.79 HSD17B10 (0.33) DDB1CRBNHSD17B10TPSAB1TPSD1
SCHEMBL7698260 0.79 HSD17B10 (0.33) DDB1CRBNHSD17B10TPSAB1TPSD1
SCHEMBL7172090 0.79 FAAH (0.35) DDB1CRBNHSD17B10TPSAB1TPSD1
SCHEMBL10435137 0.77 MME (0.37) DDB1CRBNHSD17B10TPSAB1TPSD1
SCHEMBL31486428 0.77 KLK7 (0.49) NR1H2STSKLK7
SCHEMBL8669568 0.77 KLK7 (0.49) NR1H2STSKLK7
SCHEMBL5065670 0.77 KLK7 (0.49) NR1H2STSKLK7

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
US-5021439-A Senile dementia and memory dysfunction TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-06-04 US disclosed
EP-0367393-A2 New heterocyclic compounds, production and use thereof Takeda Chemical Industries, Ltd. (JP) 1990-05-09 EP disclosed