SCHEMBL23978133

SCHEMBL23978133

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

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
HIF1A Q16665 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
PPARA Q07869 8/20 0.36
PPARG P37231 8/20 0.36
S1PR1 P21453 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL23969524 0.92 S1PR1 (0.37) HPGDL3MBTL1LMNAHIF1ANPC1
SCHEMBL23965598 0.91 MAPT (0.37) HPGDL3MBTL1LMNAHIF1ANPC1
SCHEMBL23967970 0.91 S1PR1 (0.41) HPGDLMNAHIF1ANPC1RAB9A
SCHEMBL23965585 0.91 GAA (0.41) HPGDL3MBTL1LMNAHIF1ANPC1
SCHEMBL23978207 0.90 SMN1; SMN2 (0.38) LMNAHIF1ANPC1RAB9APPARA
SCHEMBL23965635 0.89 KDM4E (0.35) HPGDHTTHIF1ANPC1RAB9A
SCHEMBL23965663 0.87 MEN1 (0.40) HIF1APPARAPPARGKMT2A
SCHEMBL23965592 0.86
SCHEMBL23965671 0.85 HIF1A (0.44) HPGDL3MBTL1LMNAMAPK1HTT
SCHEMBL23965669 0.85 HPGD (0.38) HPGDL3MBTL1LMNAMAPK1HTT

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-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