SCHEMBL7600231

SCHEMBL7600231

C[C@H](c1ccc(Br)cc1)N(C(=O)C(c1ccccc1)c1ccccc1)[C@H](CCCNC(=O)OCc1ccccc1)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.45
MMP1 P03956 1/20 0.44
MMP2 P08253 1/20 0.44
MMP3 P08254 1/20 0.44
MMP7 P09237 1/20 0.44
MMP9 P14780 1/20 0.44
MMP13 P45452 1/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
HTT P42858 1/20 0.43
SLC1A3 P43003 1/20 0.42
SLC1A1 P43005 1/20 0.42
DPP8 Q6V1X1 1/20 0.40
DPP7 Q9UHL4 1/20 0.40
TGM2 P21980 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL7600359 1.00 FOLH1 (0.45) FOLH1MMP1MMP2MMP3MMP7
SCHEMBL7595812 0.94 FOLH1 (0.49) FOLH1HTTSLC1A3SLC1A1DPP8
SCHEMBL7597839 0.94 FOLH1 (0.49) FOLH1HTTSLC1A3SLC1A1DPP8
SCHEMBL7595116 0.93 FOLH1 (0.46) FOLH1HTTSLC1A3SLC1A1DPP8
SCHEMBL7597117 0.93 FOLH1 (0.46) FOLH1HTTSLC1A3SLC1A1DPP8
SCHEMBL7601605 0.92 FOLH1 (0.47) FOLH1MMP1MMP2MMP3MMP7
SCHEMBL7600868 0.91 FOLH1 (0.45) FOLH1HTTSLC1A3SLC1A1DPP8
SCHEMBL7598850 0.90 ALOX5 (0.49) FOLH1MMP2MMP9HTT
SCHEMBL7600355 0.90 CA1 (0.45) FOLH1CNR1CNR2HTTSLC1A3
SCHEMBL7597929 0.90 CA1 (0.45) FOLH1CNR1CNR2HTTSLC1A3

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-1017672-B1 NEW NPY ANTAGONISTS ASTRAZENECA AB (SE) 2002-11-27 EP disclosed