SCHEMBL8532277

SCHEMBL8532277

O=C1CC[C@@H](C(=O)c2ccc(CO)cc2)N1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
GAA P10253 1/20 0.45
DDB1 Q16531 2/20 0.44
CRBN Q96SW2 2/20 0.44
MMP2 P08253 2/20 0.38
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38
MMP7 P09237 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.36
LMNA P02545 1/20 0.36
PARP1 P09874 3/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MCL1 Q07820 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 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
SCHEMBL11037176 0.88 SMN1; SMN2 (0.44) SMN1; SMN2GAADDB1CRBNMEN1
SCHEMBL11311666 0.81 MGLL (0.43) SMN1; SMN2DDB1CRBNMEN1KMT2A
SCHEMBL8536487 0.80 MCL1 (0.49) SMN1; SMN2GAADDB1CRBNMEN1
SCHEMBL8533046 0.80 MCL1 (0.49) SMN1; SMN2GAADDB1CRBNMEN1
SCHEMBL8533043 0.80 MCL1 (0.49) SMN1; SMN2GAADDB1CRBNMEN1
SCHEMBL993051 0.80 MCL1 (0.45) SMN1; SMN2GAAMEN1KMT2APOLB
SCHEMBL10531994 0.79 MCL1 (0.44) SMN1; SMN2GAAMEN1KMT2AMCL1
SCHEMBL1933595 0.79 MCL1 (0.44) SMN1; SMN2GAAMEN1KMT2AMCL1
SCHEMBL8028222 0.78 MCL1 (0.39) SMN1; SMN2GAAMEN1KMT2APOLB
SCHEMBL598825 0.78 SMN1; SMN2 (0.44) SMN1; SMN2MEN1KMT2AMCL1

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-0885869-A1 THERAPEUTIC AGENT FOR DIABETES Japan Tobacco Inc. (JP) 1998-12-23 EP disclosed