SCHEMBL30451657

SCHEMBL30451657

Cc1nnc(N)c2ccc(-c3cccc(B(O)O)c3)cc12

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.56
F12 P00748 1/20 0.56
F11 P03951 1/20 0.56
KLKB1 P03952 1/20 0.56
PRSS1 P07477 1/20 0.56
PRSS2 P07478 1/20 0.56
PRSS3 P35030 1/20 0.56
MGLL Q99685 2/20 0.46
ENPP2 Q13822 4/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAP4K4 O95819 7/20 0.36
DHFR P00374 1/20 0.33
PDPK1 O15530 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL24252733 1.00 PLG (0.56) PLGF12F11KLKB1PRSS1
SCHEMBL26771032 0.90 PLG (0.45) PLGF12F11KLKB1PRSS1
SCHEMBL30453230 0.84 PLG (0.39) PLGF12F11KLKB1PRSS1
SCHEMBL24252359 0.84 PLG (0.39) PLGF12F11KLKB1PRSS1
SCHEMBL24252369 0.83 PLG (0.42) PLGF12F11KLKB1PRSS1
SCHEMBL24252257 0.83 PLG (0.52) PLGF12F11KLKB1PRSS1
Hydrochloric Acid SCHEMBL30467690 0.82 PLG (0.51) PLGF12F11KLKB1PRSS1
SCHEMBL24252263 0.81 MAP4K4 (0.37) PLGF12F11KLKB1PRSS1
SCHEMBL30467557 0.80 PLG (0.36) PLGF12F11KLKB1PRSS1
SCHEMBL24252711 0.80 PLG (0.36) PLGF12F11KLKB1PRSS1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116947903-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-10-27 CN disclosed
CN-116261564-A Inhibitors of complement factors and uses thereof 安尼艾克松股份有限公司 2023-06-13 CN disclosed
EP-4185592-A1 INHIBITORS OF COMPLEMENT FACTORS AND USES THEREOF Annexon, Inc. (US) 2023-05-31 EP disclosed