SCHEMBL23143345

SCHEMBL23143345

Oc1c(-c2ccncc2)nnc2ncnn12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ ALDH1A1 P00352 4/20 0.34
▸ GAA P10253 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ GLA P06280 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MAP4K4 O95819 2/20 0.32
▸ MAPK9 P45984 2/20 0.32
▸ CSNK1A1 P48729 2/20 0.32
▸ CSNK1D P48730 2/20 0.32
▸ MAP4K5 Q9Y4K4 2/20 0.32
▸ PRKD3 O94806 1/20 0.32
▸ FRK P42685 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ PRKD2 Q9BZL6 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ MET P08581 1/20 0.32
▸ MKNK1 Q9BUB5 1/20 0.32

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
SCHEMBL23143384 0.67 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1GAAKDM4EGLA
SCHEMBL18878966 0.67 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1GAAKDM4EGLA
SCHEMBL20272449 0.67 KDM4E (0.49) SMN1; SMN2ALDH1A1GAAKDM4EGLA
SCHEMBL18878964 0.64 KDM4E (0.42) SMN1; SMN2ALDH1A1GAAKDM4EGLA
SCHEMBL23143378 0.62 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1GAAKDM4EHPGD
SCHEMBL1333523 0.61 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1GAAKDM4EGLA
SCHEMBL23143346 0.60 PDE3B (0.42) MKNK1CDK1CDK2
SCHEMBL23143440 0.60 EGLN2 (0.64) SMN1; SMN2GAALMNAMAPTMKNK1
SCHEMBL868954 0.59 KDM4E (0.49) SMN1; SMN2ALDH1A1GAAKDM4EGLA
SCHEMBL23143450 0.59 DYRK1A (0.41) LMNAMAPTMAP4K4NSD3

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
WO-2021058595-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-04-01 — — WO disclosed
WO-2021058595-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-04-01 — — WO disclosed
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