SCHEMBL4756957

SCHEMBL4756957

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nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
MMP9 P14780 1/20 0.42
MMP13 P45452 1/20 0.42
CA2 P00918 1/20 0.42
MAPK1 P28482 1/20 0.42
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
TSHR P16473 2/20 0.40
CHRM1 P11229 1/20 0.38
AKR1A1 P14550 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38

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
SCHEMBL27513922 0.83 LMNA (0.42) LMNAMMP1MMP2MMP3MMP9
SCHEMBL3237667 0.83 FOLH1 (0.43) LMNAMMP1MMP2MMP3MMP9
SCHEMBL2921467 0.82 SLC1A3 (0.47) LMNAMMP1MMP2MMP3MMP9
SCHEMBL10597893 0.78 CA2 (0.45) CA2MAPK1SLC1A3SLC1A2SLC1A1
SCHEMBL4753845 0.78 CA2 (0.45) CA2MAPK1SLC1A3SLC1A2SLC1A1
SCHEMBL27784485 0.78 MMP1 (0.48) LMNAMMP1MMP2MMP3MMP9
SCHEMBL4755497 0.77 MGAM (0.46) LMNACA2MAPK1SLC1A3SLC1A2
SCHEMBL1823767 0.77 MGAM (0.46) LMNACA2MAPK1SLC1A3SLC1A2
SCHEMBL12224068 0.76 LMNA (0.47) LMNAMMP1MMP2MMP3MMP9
SCHEMBL4753693 0.76 MMP1 (0.47) LMNAMMP1MMP2MMP3MMP9

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
WO-2008155619-A2 PREPARATION OF OPTICALLY-ACTIVE CYCLIC AMINO ACIDS PFIZER INC. (US) 2008-12-24 WO disclosed