SCHEMBL28574538

SCHEMBL28574538

CCN(C)C(N)=Nc1cc(C)c(Sc2cccc(OC(F)F)c2)cc1C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ACHE P22303 2/20 0.32
▸ FAAH O00519 1/20 0.32
▸ BCHE P06276 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL15022386 0.80 DRD1 (0.32) —
SCHEMBL29367933 0.80 DRD1 (0.32) —
SCHEMBL15022387 0.80 DRD1 (0.32) —
SCHEMBL16417051 0.80 DRD1 (0.32) —
SCHEMBL20920141 0.79 ACHE (0.34) L3MBTL1MEN1KMT2AACHEFAAH
SCHEMBL30166535 0.79 ACHE (0.34) L3MBTL1MEN1KMT2AACHEFAAH
SCHEMBL28452046 0.77 FURIN (0.30) —
SCHEMBL28443260 0.76 GAA (0.38) MEN1KMT2AACHEFAAHBCHE
SCHEMBL28452144 0.74 SIGMAR1 (0.32) —
SCHEMBL22928 0.73 DHFR (0.36) MEN1NPC1KMT2AGAASMN1; 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
CN-112912374-A Oxocyclobutylphenoxyquinolines and analogs 拜耳公司 2021-06-04 — — CN disclosed
CN-112702913-A Controlled release formulations for agrochemicals 拜耳公司 2021-04-23 — — CN disclosed
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