SCHEMBL28529383

SCHEMBL28529383

CCN(NC)C(=O)c1cc(C)c(Sc2cccc(OC(F)F)c2)cc1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ PKM P14618 1/20 0.34
▸ MEP1B Q16820 1/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 3/20 0.34
▸ TSHR P16473 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MTNR1A P48039 1/20 0.33
▸ MTNR1B P49286 1/20 0.33
▸ TAS2R14 Q9NYV8 1/20 0.33
▸ ATM Q13315 1/20 0.32
▸ GRM4 Q14833 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ NPC1 O15118 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
SCHEMBL28533263 0.86 ALDH1A1 (0.38) RAB9ASMN1; SMN2GAAMAPTMEN1
SCHEMBL20920141 0.80 ACHE (0.34) RAB9AL3MBTL1PKMMEP1BSMN1; SMN2
SCHEMBL30166535 0.80 ACHE (0.34) RAB9AL3MBTL1PKMMEP1BSMN1; SMN2
SCHEMBL30714954 0.75 SMN1; SMN2 (0.35) RAB9AL3MBTL1PKMSMN1; SMN2GAA
SCHEMBL28443260 0.73 GAA (0.38) MEP1BSMN1; SMN2GAAMAPTTSHR
SCHEMBL22928 0.71 DHFR (0.36) SMN1; SMN2GAAMAPTTSHRMAPK1
SCHEMBL28574538 0.71 L3MBTL1 (0.36) L3MBTL1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL15022386 0.70 DRD1 (0.32) —
SCHEMBL16417051 0.70 DRD1 (0.32) —
SCHEMBL29367933 0.70 DRD1 (0.32) —

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-107846888-B Heterocyclic compounds as pesticides 拜耳作物科学股份公司 2021-02-26 — — CN disclosed
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