SCHEMBL28913028

SCHEMBL28913028

CC(C)Sc1c(Br)ccc(OC(N)=O)c1C(C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 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
SCHEMBL28913197 0.77 CHRNA1 (0.32)
SCHEMBL28913034 0.75 MEN1 (0.34)
SCHEMBL28587717 0.69 POLB (0.42) PTGDR2
SCHEMBL27947755 0.68 PTGDR2 (0.40) PTGDR2
SCHEMBL2481471 0.67 KMT2A (0.40)
SCHEMBL28969394 0.67 PTGDR2 (0.33) PTGDR2
SCHEMBL4557407 0.67 PDE4D (0.34) PTGDR2
SCHEMBL31345640 0.66 CES2 (0.36)
SCHEMBL28714655 0.66 NR1H4 (0.35)
SCHEMBL31265698 0.65 POLB (0.33)

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
CN-115315423-A Substituted aryl compounds 先声药业有限公司 2022-11-08 CN disclosed