SCHEMBL7601605

SCHEMBL7601605

C[C@H](c1ccc(-c2ccccc2)cc1)N(C(=O)C(c1ccccc1)c1ccccc1)[C@H](CCCNC(=O)OCc1ccccc1)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 5/20 0.47
MMP2 P08253 5/20 0.46
MMP9 P14780 5/20 0.46
MMP3 P08254 3/20 0.45
MMP14 P50281 2/20 0.45
MMP1 P03956 2/20 0.45
MMP7 P09237 2/20 0.45
HTT P42858 1/20 0.43
MMP13 P45452 1/20 0.43
SLC1A3 P43003 1/20 0.42
SLC1A1 P43005 1/20 0.42
CPB1 P15086 1/20 0.42
CPB2 Q96IY4 1/20 0.42
SIRT2 Q8IXJ6 1/20 0.41

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
SCHEMBL7595812 0.95 FOLH1 (0.49) FOLH1HTTSLC1A3SLC1A1CPB1
SCHEMBL7597839 0.95 FOLH1 (0.49) FOLH1HTTSLC1A3SLC1A1CPB1
SCHEMBL7597117 0.94 FOLH1 (0.46) FOLH1HTTSLC1A3SLC1A1CPB1
SCHEMBL7595116 0.94 FOLH1 (0.46) FOLH1HTTSLC1A3SLC1A1CPB1
SCHEMBL7600868 0.92 FOLH1 (0.45) FOLH1HTTSLC1A3SLC1A1
SCHEMBL7600359 0.92 FOLH1 (0.45) FOLH1MMP2MMP9MMP3MMP1
SCHEMBL7600231 0.92 FOLH1 (0.45) FOLH1MMP2MMP9MMP3MMP1
SCHEMBL7597929 0.91 CA1 (0.45) FOLH1HTTSLC1A3SLC1A1
SCHEMBL7600355 0.91 CA1 (0.45) FOLH1HTTSLC1A3SLC1A1
SCHEMBL7600672 0.91 FOLH1 (0.44) FOLH1HTTSLC1A3SLC1A1CPB1

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