SCHEMBL4098480

SCHEMBL4098480

CC(=O)Nc1ncc(Br)cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 5/20 0.42
DYRK1B Q9Y463 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 4/20 0.38
PKM P14618 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPC1 O15118 4/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KCNH2 Q12809 1/20 0.38
S100A9 P06702 1/20 0.38
RAB9A P51151 3/20 0.37
POLB P06746 1/20 0.37
EGFR P00533 1/20 0.36
GAA P10253 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL11637557 0.84 MAPT (0.51) DYRK1ADYRK1BL3MBTL1MAPTPKM
SCHEMBL1433126 0.82 DYRK1A (0.42) DYRK1ADYRK1BL3MBTL1MAPTPKM
SCHEMBL760353 0.82 NPC1 (0.48) DYRK1ADYRK1BL3MBTL1MAPTPKM
SCHEMBL11982873 0.81 DYRK1A (0.41) DYRK1ADYRK1BL3MBTL1MAPTPKM
SCHEMBL1516710 0.81 DYRK1A (0.43) DYRK1ADYRK1BL3MBTL1MAPTPKM
SCHEMBL2404084 0.80 ALDH1A1 (0.39) DYRK1ADYRK1BL3MBTL1SMN1; SMN2CYP3A4
SCHEMBL4102739 0.79 ALDH1A1 (0.43) DYRK1ADYRK1BL3MBTL1NPC1KCNH2
SCHEMBL12836716 0.79 DYRK1A (0.40) DYRK1ADYRK1BL3MBTL1MAPTPKM
SCHEMBL14231805 0.78 DYRK1A (0.39) DYRK1ADYRK1BL3MBTL1MAPTPKM
SCHEMBL29360815 0.78 AAK1 (0.43) DYRK1ANPC1SMN1; SMN2RAB9AEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156578-A1 3-Heterocyclylacrylamide Compounds as Fab I Inhibitors and Antibacterial Agents DEBIOPHARM INTERNATIONAL SA (CH) 2009-06-18 US disclosed
US-20090156578-A1 3-Heterocyclylacrylamide Compounds as Fab I Inhibitors and Antibacterial Agents DEBIOPHARM INTERNATIONAL SA (CH) 2009-06-18 US disclosed
US-20090156578-A1 3-Heterocyclylacrylamide Compounds as Fab I Inhibitors and Antibacterial Agents DEBIOPHARM INTERNATIONAL SA (CH) 2009-06-18 US disclosed
CN-101415701-A Heterocyclylacrylamide compounds as FABI inhibitors and antibacterial agents AFFINIUM PHARM INC (CA) 2009-04-22 CN disclosed
EP-1973902-A2 3-HETEROCYCLYLACRYLAMIDE COMPOUNDS AS FABI INHIBITORS AND ANTIBACTERIAL AGENTS Affinium Pharmaceuticals, Inc. (CA) 2008-10-01 EP disclosed
WO-2007067416-A2 HETEROCYCLYLACRYLAMIDE COMPOUNDS AS FABI INHIBITORS AND ANTIBACTERIAL AGENTS AFFINIUM PHARMACEUTICALS, INC. (CA) 2007-06-14 WO disclosed
WO-2007067416-A2 HETEROCYCLYLACRYLAMIDE COMPOUNDS AS FABI INHIBITORS AND ANTIBACTERIAL AGENTS AFFINIUM PHARMACEUTICALS, INC. (CA) 2007-06-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090156578-A1 3-Heterocyclylacrylamide Compounds as Fab I Inhibitors and Antibacterial Agents GAA, TFPI, DBI DYRK1A 4556/4885DYRK1B 4714/4885L3MBTL1 2179/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.