SCHEMBL17804388

SCHEMBL17804388

Cn1c(=O)n(CC2CO2)c(=O)n(C[C@H]2CO2)c1=O

nearest known ligand 0.78

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.78
HBB P68871 1/20 0.78
SMN1; SMN2 Q16637 1/20 0.78
DHFR P00374 1/20 0.42
HTT P42858 1/20 0.34
MAPT P10636 1/20 0.34
PDE5A O76074 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
GRIN1 Q05586 3/20 0.32
GRIN2B Q13224 3/20 0.32
TRPA1 O75762 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 2/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 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
SCHEMBL1715098 1.00 TP53 (0.78) TP53HBBSMN1; SMN2DHFRHTT
SCHEMBL10942045 0.96 TP53 (0.71) TP53HBBSMN1; SMN2DHFRHTT
SCHEMBL22047578 0.96 TP53 (0.71) TP53HBBSMN1; SMN2DHFRHTT
Teroxirone SCHEMBL4461477 0.89 TP53 (1.00) TP53HBBSMN1; SMN2DHFRMAPT
Teroxirone SCHEMBL2097375 0.89 TP53 (1.00) TP53HBBSMN1; SMN2DHFRMAPT
Teroxirone SCHEMBL4452999 0.89 TP53 (1.00) TP53HBBSMN1; SMN2DHFRMAPT
Teroxirone SCHEMBL4472568 0.89 TP53 (1.00) TP53HBBSMN1; SMN2DHFRMAPT
Teroxirone SCHEMBL4932 0.89 TP53 (1.00) TP53HBBSMN1; SMN2DHFRMAPT
Teroxirone SCHEMBL2097151 0.89 TP53 (1.00) TP53HBBSMN1; SMN2DHFRMAPT
Teroxirone SCHEMBL4470513 0.89 TP53 (1.00) TP53HBBSMN1; SMN2DHFRMAPT

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-3029105-A1 THERMOSETTING RESIN COMPOSITION, SLIDING MEMBER AND METHOD FOR PRODUCING SLIDING MEMBER Minebea Co., Ltd. (JP) 2016-06-08 EP disclosed