SCHEMBL31711599

SCHEMBL31711599

CO/C=C(/C(=O)OC)c1cccc(C)c1CO/N=C(\COC)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.31

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
SCHEMBL31711609 1.00 NPC1 (0.36) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL31711600 0.91 KMT2A (0.38) NPC1RAB9ASMN1; SMN2KMT2AKDM4E
SCHEMBL31711607 0.91 KMT2A (0.38) NPC1RAB9ASMN1; SMN2KMT2AKDM4E
SCHEMBL31711597 0.91 ALDH1A1 (0.39) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL31711576 0.91 ALDH1A1 (0.39) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL31711572 0.90 TDP1 (0.35) NPC1RAB9ASMN1; SMN2L3MBTL1KDM4E
SCHEMBL31711574 0.90 L3MBTL1 (0.40) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL27208793 0.90 L3MBTL1 (0.40) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL31711579 0.85
SCHEMBL31114708 0.85

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-4640052-A1 MIXTURES 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 WITH AT LEAST ONE FURTHER PESTICIDE I BASF SE (DE) 2025-10-29 EP disclosed