SCHEMBL8788079

SCHEMBL8788079

COC(=O)/C(C)=C\C(=O)Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.64
▸ LMNA P02545 5/20 0.64
▸ ALDH1A1 P00352 4/20 0.64
▸ GAA P10253 2/20 0.64
▸ HTT P42858 3/20 0.56
▸ PKM P14618 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ NPSR1 Q6W5P4 2/20 0.55
▸ HSP90AA1 P07900 1/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.55
▸ TP53 P04637 1/20 0.53
▸ RAB9A P51151 1/20 0.52
▸ XBP1 P17861 1/20 0.52
▸ NPC1 O15118 1/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.49
▸ MAOB P27338 1/20 0.48
▸ THRB P10828 1/20 0.48

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
SCHEMBL8788081 1.00 MAPT (0.64) MAPTLMNAALDH1A1GAAHTT
SCHEMBL8788070 1.00 MAPT (0.64) MAPTLMNAALDH1A1GAAHTT
SCHEMBL8787978 0.86 ALDH1A1 (0.64) MAPTLMNAALDH1A1GAAHTT
SCHEMBL8787974 0.86 ALDH1A1 (0.64) MAPTLMNAALDH1A1GAAHTT
SCHEMBL11677558 0.86 MAPT (0.67) MAPTLMNAALDH1A1GAAHTT
SCHEMBL11677569 0.86 MAPT (0.67) MAPTLMNAALDH1A1GAAHTT
SCHEMBL8787970 0.86 ALDH1A1 (0.64) MAPTLMNAALDH1A1GAAHTT
SCHEMBL8789030 0.84 MAPT (0.52) MAPTLMNAALDH1A1GAAHTT
SCHEMBL8789034 0.84 MAPT (0.52) MAPTLMNAALDH1A1GAAHTT
SCHEMBL8789024 0.84 MAPT (0.52) MAPTLMNAALDH1A1GAAHTT

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-0763020-A1 SUBSTITUTED PYRROLIDONE, THIAZOLIDONES OR OXAZOLIDONES AS HERBICIDES ZENECA LIMITED (GB) 1997-03-19 — — EP disclosed
WO-1995033719-A1 SUBSTITUTED PYRROLIDONE, THIAZOLIDONES OR OXAZOLIDONES AS HERBICIDES ZENECA LIMITED (GB) 1995-12-14 — — WO disclosed
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