SCHEMBL23965621

SCHEMBL23965621

CO/N=C(/C)c1cccc(C)c1CO/N=C(\C)c1ccccc1F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
KMT2A Q03164 1/20 0.38
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RAB9A P51151 1/20 0.35
CA12 O43570 1/20 0.34
LMNA P02545 2/20 0.34
ADRA1A P35348 1/20 0.33
HIF1A Q16665 1/20 0.33
KAT6A Q92794 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL28917435 0.89 NPC1 (0.37) ALDH1A1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL25224343 0.89 NPC1 (0.37) ALDH1A1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL30168077 0.88 HIF1A (0.45) ALDH1A1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL23965620 0.88 HIF1A (0.45) ALDH1A1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL30104137 0.86 HIF1A (0.38) ALDH1A1NPC1SMN1; SMN2RAB9AHIF1A
SCHEMBL30168064 0.86 GAA (0.36) ALDH1A1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL23967964 0.86 ALDH1A1 (0.33) ALDH1A1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL23965569 0.86 GAA (0.36) ALDH1A1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL23984127 0.84 ALDH1A1 (0.32) ALDH1A1KMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL23978034 0.84 PKM (0.40) ALDH1A1KMT2ANPC1SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3903583-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 III BASF SE (DE) 2021-11-03 EP disclosed
EP-3903584-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) 2021-11-03 EP disclosed
EP-3903581-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) 2021-11-03 EP disclosed
EP-3903582-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) 2021-11-03 EP disclosed