SCHEMBL30168064

SCHEMBL30168064

CNC(=O)/C(=N/OC)c1cccc(C)c1CO/N=C(\C)c1ccccc1F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
HIF1A Q16665 4/20 0.36
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KAT6A Q92794 1/20 0.33
KMT2A Q03164 1/20 0.33
PKM P14618 1/20 0.33
MAPK14 Q16539 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
SCHEMBL23965569 1.00 GAA (0.36) GAAHIF1ANPC1SMN1; SMN2RAB9A
SCHEMBL30214721 0.96 HIF1A (0.41) GAAHIF1ANPC1SMN1; SMN2RAB9A
SCHEMBL23971862 0.93 HIF1A (0.33) GAAHIF1AKAT6AMAPK14
SCHEMBL23971847 0.92 HIF1A (0.34) GAAHIF1AKMT2AMAPK14
SCHEMBL25551488 0.92 HIF1A (0.35) HIF1AKAT6A
SCHEMBL23972050 0.92 HIF1A (0.40) GAAHIF1AALDH1A1
SCHEMBL23971888 0.92 HIF1A (0.38) GAAHIF1ANPC1SMN1; SMN2RAB9A
SCHEMBL23971893 0.90 HIF1A (0.34) HIF1ANPC1SMN1; SMN2RAB9AALDH1A1
SCHEMBL23971863 0.90 KDM4E (0.39) GAAHIF1AMAPK14
SCHEMBL25598383 0.90 HIF1A (0.34) GAAHIF1ANPC1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023072670-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 X BASF SE (DE) 2023-05-04 WO disclosed
WO-2023072671-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 IX BASF SE (DE) 2023-05-04 WO disclosed
EP-4142497-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 I BASF SE (DE) 2023-03-08 EP disclosed
EP-4142494-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 II BASF SE (DE) 2023-03-08 EP disclosed
EP-4142496-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 IV BASF SE (DE) 2023-03-08 EP disclosed
CN-115484821-A Use of strobilurin-type compounds to control phytopathogenic fungi containing the amino acid substitution F129L in the mitochondrial cytochrome b protein conferring tolerance to Qo inhibitor III 巴斯夫欧洲公司 2022-12-16 CN disclosed