SCHEMBL21723143

SCHEMBL21723143

[O-]c1n[n+]2c(Cc3cnc(Cl)s3)cccc2n1Cc1ccc(Cl)nc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ KMT2A Q03164 4/20 0.33
▸ CHRNA7 P36544 3/20 0.33
▸ CHRNA1 P02708 2/20 0.33
▸ CHRNB2 P17787 2/20 0.33
▸ CHRNA4 P43681 2/20 0.33
▸ GRM2 Q14416 1/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ LMNA P02545 2/20 0.32
▸ TDP1 Q9NUW8 2/20 0.32
▸ MEN1 O00255 1/20 0.31

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
SCHEMBL21731432 0.86 KMT2A (0.36) GAAMAPTALDH1A1KMT2ACHRNA7
SCHEMBL21723112 0.80 ALDH1A1 (0.31) ALDH1A1L3MBTL1
SCHEMBL21723151 0.77 GAA (0.31) GAAMAPTL3MBTL1
SCHEMBL21731423 0.76 GAA (0.34) GAAMAPTALDH1A1KMT2ACHRNA7
SCHEMBL21710004 0.75 LMNA (0.40) GAAMAPTALDH1A1KMT2ALMNA
SCHEMBL21682613 0.68 LMNA (0.31) LMNA
SCHEMBL21731417 0.67 MEN1 (0.36) MAPTALDH1A1KMT2AL3MBTL1TDP1
SCHEMBL21731375 0.65 MAPT (0.32) GAAMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL21709959 0.64 KMT2A (0.38) GAAMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL17410524 0.58 LMNA (0.61) MAPTALDH1A1KMT2AL3MBTL1LMNA

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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