SCHEMBL22010255

SCHEMBL22010255

CCOC(=O)/C=C/CC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RECQL P46063 1/20 0.39
MAPT P10636 2/20 0.36
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PDK1 Q15118 3/20 0.35
ENPP2 Q13822 2/20 0.35
TSHR P16473 1/20 0.35
EPHA2 P29317 4/20 0.34
NR1H2 P55055 1/20 0.33
ERBB2 P04626 1/20 0.33
EPHB4 P54760 1/20 0.33

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
SCHEMBL18259388 1.00 USP2 (0.39) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL18259390 1.00 USP2 (0.39) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL18259389 1.00 USP2 (0.39) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL29318676 0.89 USP2 (0.41) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL18259633 0.81 USP2 (0.47) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL18259632 0.81 USP2 (0.47) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL18259631 0.81 USP2 (0.43) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL18259311 0.81 USP2 (0.43) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL18259310 0.81 USP2 (0.43) USP2SMN1; SMN2RECQLMAPTALDH1A1
SCHEMBL23877994 0.80 USP2 (0.50) USP2SMN1; SMN2RECQLMAPTALDH1A1

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-3122747-B1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS NORTH & SOUTH BROTHER PHARMACY INVESTMENT CO LTD (CN) 2020-05-20 EP disclosed