SCHEMBL28928702

SCHEMBL28928702

C[C@H](NC(=O)c1cc(Br)cc(OC(Cl)C(Cl)=CCl)c1)c1ncnn1-c1ncc(C#N)s1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.32
CYP2C8 P10632 1/20 0.30
P2RX3 P56373 1/20 0.30
P2RX2 Q9UBL9 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
SCHEMBL23464322 0.87 EGLN2 (0.34) EGLN2CYP2C8P2RX3P2RX2
SCHEMBL23464312 0.86 EGLN2 (0.37) EGLN2
SCHEMBL25178851 0.85 EGLN2 (0.33) EGLN2P2RX3P2RX2
SCHEMBL30045023 0.85 EGLN2 (0.33) EGLN2P2RX3P2RX2
SCHEMBL25178849 0.85 EGLN2 (0.33) EGLN2P2RX3P2RX2
SCHEMBL26146732 0.83 P2RX3 (0.40) P2RX3P2RX2
SCHEMBL26146745 0.83 P2RX3 (0.36) EGLN2P2RX3P2RX2
SCHEMBL23464305 0.82 EGLN2 (0.34) EGLN2
SCHEMBL26146756 0.82 P2RX3 (0.33) EGLN2P2RX3P2RX2
SCHEMBL23464466 0.81 EGLN2 (0.36) EGLN2CYP2C8P2RX3P2RX2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115551839-B Heteroaryl-triazole compounds as pesticides 拜耳公司 2024-06-04 CN disclosed
CN-115551839-A Heteroaryl-triazole compounds as pesticides 拜耳公司 2022-12-30 CN disclosed