SCHEMBL9325262

SCHEMBL9325262

CC(C)(CO)COC(=O)CN

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NUDT1 P36639 3/20 0.31

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
SCHEMBL15892076 0.82 SERPINE1 (0.33) SERPINE1
SCHEMBL21143363 0.82 ADRA2A (0.38) SERPINE1
SCHEMBL13380218 0.82 MGAM (0.44) SERPINE1KDM4E
SCHEMBL17746187 0.81 MGAM (0.44) SERPINE1KDM4E
SCHEMBL27853451 0.80 NAAA (0.39) SERPINE1LMNAHSD17B10KDM4ENUDT1
SCHEMBL1851945 0.79 LMNA (0.34) LMNAHSD17B10KDM4E
SCHEMBL1468348 0.78 TSHR (0.41) SERPINE1HSD17B10
SCHEMBL21143386 0.78 TSHR (0.41) LMNAKDM4E
SCHEMBL8997470 0.78 CYP4F2 (0.32) SERPINE1
SCHEMBL274635 0.78 DGKA (0.42) LMNAKDM4E

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
EP-3596064-B1 TOSYLACETATE BASED COMPOUNDS AND DERIVATIVES THEREOF AS PHGDH INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-03-03 EP disclosed
US-5324706-A Improved adhesion between support and dye layer; thermostability AGFA-GEVAERT, N.V. (BE) 1994-06-28 US disclosed