SCHEMBL21723112

SCHEMBL21723112

C#CCn1c([O-])n[n+]2c(Cc3cnc(Cl)s3)cccc12

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ ALOX12 P18054 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL21731417 0.85 MEN1 (0.36) ALDH1A1ALOX12L3MBTL1
SCHEMBL21723143 0.80 GAA (0.34) ALDH1A1L3MBTL1
SCHEMBL21710004 0.77 LMNA (0.40) ALDH1A1
SCHEMBL21731418 0.75 ALOX12 (0.32) ALDH1A1ALOX12L3MBTL1
SCHEMBL21731432 0.68 KMT2A (0.36) ALDH1A1L3MBTL1
SCHEMBL21709959 0.66 KMT2A (0.38) ALDH1A1L3MBTL1
SCHEMBL21723151 0.64 GAA (0.31) L3MBTL1
SCHEMBL8447855 0.59 — —
SCHEMBL21731427 0.57 APP (0.34) ALDH1A1ALOX12L3MBTL1
SCHEMBL13221313 0.57 — —

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
WO-2020035565-A1 PESTICIDALLY-ACTIVE MESOIONIC BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-02-20 — — WO disclosed
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