SCHEMBL29789892

SCHEMBL29789892

C[Si](C)(C)CCOc1ccc(C(N)=O)cn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NNMT P40261 4/20 0.61
▸ MKNK1 Q9BUB5 1/20 0.48
▸ MKNK2 Q9HBH9 1/20 0.48
▸ MAPT P10636 1/20 0.47
▸ GABRA1 P14867 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ OPRM1 P35372 4/20 0.44
▸ OPRD1 P41143 4/20 0.44
▸ OPRK1 P41145 4/20 0.44
▸ CHEK2 O96017 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ EPHX2 P34913 2/20 0.41
▸ PARP10 Q53GL7 1/20 0.40
▸ GRIN2D O15399 1/20 0.40
▸ GRIN3B O60391 1/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ GRIN1 Q05586 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ GRIN2A Q12879 1/20 0.40

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
SCHEMBL29585645 0.83 NNMT (0.68) NNMTMKNK1MKNK2MAPTGABRA1
SCHEMBL29683986 0.82 NNMT (0.62) NNMTMKNK1MKNK2MAPTGABRA1
SCHEMBL11551255 0.82 NNMT (0.62) NNMTMKNK1MKNK2MAPTGABRA1
SCHEMBL23834721 0.82 NNMT (0.62) NNMTMKNK1MKNK2MAPTGABRA1
SCHEMBL1680864 0.81 NNMT (0.61) NNMTMKNK1MKNK2MAPTSMN1; SMN2
SCHEMBL2817347 0.80 MAPT (0.72) NNMTMKNK1MKNK2MAPTGABRA1
SCHEMBL6953681 0.80 NNMT (0.59) NNMTMKNK1MKNK2MAPTOPRM1
Hydrochloric Acid SCHEMBL5010367 0.79 MAPT (0.70) NNMTMKNK1MKNK2MAPTGABRA1
SCHEMBL30969236 0.78 NNMT (0.56) NNMTMKNK1MKNK2MAPTGABRA1
SCHEMBL29975550 0.76 NNMT (1.00) NNMTMKNK1MKNK2MAPTSMN1; SMN2

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
EP-3423451-B1 INHIBITORS OF WDR5 PROTEIN-PROTEIN BINDING PROPELLON THERAPEUTICS INC (CA) 2022-08-17 — — EP disclosed
CN-109195965-B Inhibitors of WDR5 protein-protein binding 普罗佩纶治疗公司 2022-07-26 — — CN disclosed
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