SCHEMBL8789024

SCHEMBL8789024

C/C(=C\C(=O)Nc1cccc(C(F)(F)F)c1)C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.52
▸ ALDH1A1 P00352 5/20 0.52
▸ LMNA P02545 3/20 0.52
▸ GAA P10253 2/20 0.52
▸ MGLL Q99685 1/20 0.52
▸ PPIA P62937 1/20 0.52
▸ MEN1 O00255 5/20 0.50
▸ KMT2A Q03164 5/20 0.50
▸ HTT P42858 3/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ RXFP1 Q9HBX9 3/20 0.48
▸ XBP1 P17861 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ PKM P14618 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.47
▸ HSP90AA1 P07900 1/20 0.47

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
SCHEMBL8789030 1.00 MAPT (0.52) MAPTALDH1A1LMNAGAAMGLL
SCHEMBL8789034 1.00 MAPT (0.52) MAPTALDH1A1LMNAGAAMGLL
SCHEMBL8788070 0.84 MAPT (0.64) MAPTALDH1A1LMNAGAAMEN1
SCHEMBL8788081 0.84 MAPT (0.64) MAPTALDH1A1LMNAGAAMEN1
SCHEMBL8788079 0.84 MAPT (0.64) MAPTALDH1A1LMNAGAAMEN1
SCHEMBL20029049 0.83 MGLL (0.59) MAPTALDH1A1LMNAGAAMGLL
SCHEMBL8787978 0.81 ALDH1A1 (0.64) MAPTALDH1A1LMNAGAAMEN1
SCHEMBL8787970 0.81 ALDH1A1 (0.64) MAPTALDH1A1LMNAGAAMEN1
SCHEMBL8787974 0.81 ALDH1A1 (0.64) MAPTALDH1A1LMNAGAAMEN1
SCHEMBL19688778 0.80 MGLL (0.76) MAPTALDH1A1LMNAGAAMGLL

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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