SCHEMBL30876174

SCHEMBL30876174

COC/C(=N\OCc1c(Cl)cccc1C(=NOC)C(=O)O)c1ccccc1Br

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
HPGD P15428 1/20 0.34
PTGS2 P35354 1/20 0.34
LMNA P02545 1/20 0.33
HIF1A Q16665 3/20 0.32
PTGES O14684 1/20 0.31
GAA P10253 1/20 0.31
MC4R P32245 1/20 0.31
KCNH2 Q12809 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL27208802 1.00 ALDH1A1 (0.34) ALDH1A1L3MBTL1HPGDPTGS2LMNA
SCHEMBL27208776 0.91 HIF1A (0.41) ALDH1A1LMNAHIF1APTGESGAA
SCHEMBL27208777 0.83 PPARG (0.35) ALDH1A1L3MBTL1HPGDPTGS2GAA
SCHEMBL27208787 0.81 HIF1A (0.44) ALDH1A1L3MBTL1HPGDPTGS2LMNA
SCHEMBL27208804 0.79 ALDH1A1 (0.38) ALDH1A1L3MBTL1HPGDPTGS2LMNA
SCHEMBL27208792 0.75 AKR1B1 (0.39) ALDH1A1L3MBTL1HPGDLMNAHIF1A
SCHEMBL8018554 0.73 ALDH1A1 (0.50) ALDH1A1L3MBTL1HPGDGAAKMT2A
SCHEMBL8018552 0.73 ALDH1A1 (0.50) ALDH1A1L3MBTL1HPGDGAAKMT2A
SCHEMBL30906641 0.73 KMT2A (0.34) ALDH1A1L3MBTL1LMNAHIF1AGAA
SCHEMBL30906649 0.73 KMT2A (0.34) ALDH1A1L3MBTL1LMNAHIF1AGAA

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-4361126-A1 USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS XV BASF SE (DE) 2024-05-01 EP disclosed