SCHEMBL26201839

SCHEMBL26201839

CCCC1/C=C(Br)\C=C/C(=O)CC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 1/20 0.31
FYN P06241 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
SCHEMBL4817247 0.78 NFKB1 (0.33) TLR4
SCHEMBL4819563 0.69 TLR4 (0.31) TLR4
SCHEMBL23505985 0.67 AR (0.30)
SCHEMBL3373521 0.67 CYP1A2 (0.41)
SCHEMBL4099579 0.66
SCHEMBL4099577 0.66
SCHEMBL8636587 0.66 CYP1A2 (0.44)
SCHEMBL8640860 0.66 CYP1A2 (0.44)
SCHEMBL4197567 0.66 CYP1A2 (0.44)
SCHEMBL9360168 0.66 CYP1A2 (0.44)

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-3835290-B1 OXADIAZOLINE COMPOUND OR SALT THEREOF, AGRICULTURAL OR HORTICULTURAL BACTERICIDE CONTAINING SAID COMPOUND, AND USE METHOD THEREFOR NIHON NOHYAKU CO LTD (JP) 2023-09-06 EP disclosed