SCHEMBL28546264

SCHEMBL28546264

CN(C)c1ccncc1.Oc1ccc(C2=CC3=CC4=NC(=CC5=NC(=CC6=NC(=CC2=N3)C=C6)C=C5)C=C4)cc1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CHRM5 P08912 1/20 0.37
▸ CHKA P35790 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ APP P05067 3/20 0.33
▸ RPS6KA3 P51812 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
SCHEMBL27793989 0.86 MAPT (0.35) MAPTSMN1; SMN2APP
Hydrochloric Acid SCHEMBL27597698 0.84 ESR1 (0.30) —
SCHEMBL28295369 0.84 ESR1 (0.30) —
Hydrochloric Acid SCHEMBL27597701 0.84 ESR1 (0.30) —
SCHEMBL5470460 0.81 LMNA (0.32) MAPT
SCHEMBL28351486 0.79 LMNA (0.31) MAPT
Hydrochloric Acid SCHEMBL16188262 0.79 LMNA (0.31) MAPT
Hydrochloric Acid SCHEMBL16188244 0.79 LMNA (0.31) MAPT
SCHEMBL28866698 0.79 CHRM5 (0.59) CHRM5CHKAMAPTSMN1; SMN2
SCHEMBL28874540 0.73 ABL1 (0.38) MAPTSMN1; SMN2RPS6KA3

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
CN-108904804-B Fluorinated covalent organic polymer loaded with perfluorocarbon and preparation method and application thereof 苏州百迈生物医药有限公司 2021-04-06 — — CN disclosed
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