SCHEMBL27713628

SCHEMBL27713628

Cc1ccc(C2CCN(S(=O)(=O)CC(C#Cc3ccccc3)C(N)=O)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 2/20 0.43
USP5 P45974 3/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
ADRA1D P25100 1/20 0.37
ADRA1A P35348 1/20 0.37
ADRA1B P35368 1/20 0.37
HPN P05981 1/20 0.37
HGFAC Q04756 1/20 0.37
ST14 Q9Y5Y6 1/20 0.37
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HSD11B1 P28845 1/20 0.35

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
SCHEMBL16493552 0.89 MMP3 (0.46) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL2154896 0.88 MMP3 (0.48) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL5506459 0.85 MMP3 (0.43) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL2155207 0.83 MMP3 (0.46) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL27693773 0.80 USP5 (0.38) MMP3USP5KDM4EALDH1A1NPC1
SCHEMBL2154893 0.80 MMP3 (0.39) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL2156536 0.78 MMP3 (0.51) MMP3USP5KDM4EALDH1A1RAB9A
SCHEMBL5509222 0.77 MMP3 (0.50) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL2156697 0.75 MMP3 (0.44) MMP3USP5KDM4EALDH1A1SMN1; SMN2
SCHEMBL27693768 0.73 MAPT (0.47) ALDH1A1SMN1; SMN2NPC1TP53TSHR

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
CN-101124213-A Sulfonylamino cyclic derivatives and uses thereof SERONO LAB (CH) 2008-02-13 CN claimed
CN-101124213-A Sulfonylamino cyclic derivatives and uses thereof SERONO LAB (CH) 2008-02-13 CN disclosed