SCHEMBL29150883

SCHEMBL29150883

Cc1cc(O)c(C(=O)CCCc2ccccc2)c(=O)o1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.64
CBS P35520 1/20 0.56
ALDH1A1 P00352 4/20 0.52
ACHE P22303 2/20 0.51
SGMS1 Q86VZ5 2/20 0.51
SGMS2 Q8NHU3 2/20 0.51
GAA P10253 3/20 0.50
MAPT P10636 3/20 0.50
SLC5A1 P13866 1/20 0.50
SLC5A2 P31639 1/20 0.50
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
FAAH O00519 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
SCHEMBL29150893 0.95 ELANE (0.68) ELANECBSALDH1A1ACHESGMS1
SCHEMBL458844 0.92 GAA (0.60) ELANECBSALDH1A1GAAMAPT
SCHEMBL29150899 0.87 ELANE (0.61) ELANECBSALDH1A1ACHESGMS1
SCHEMBL29150901 0.85 NFKB1 (0.59) ELANEALDH1A1MAPTSLC5A1SLC5A2
SCHEMBL27035914 0.83 ELANE (0.88) ELANEALDH1A1RAB9ANPC1MEN1
SCHEMBL27035967 0.83 ELANE (0.88) ELANEALDH1A1RAB9ANPC1MEN1
SCHEMBL27035911 0.83 ELANE (0.88) ELANEALDH1A1RAB9ANPC1MEN1
SCHEMBL27035891 0.83 ELANE (0.88) ELANEALDH1A1RAB9ANPC1MEN1
SCHEMBL27035935 0.83 ELANE (0.88) ELANEALDH1A1RAB9ANPC1MEN1
SCHEMBL29150872 0.81 SLC5A1 (0.65) ELANEALDH1A1GAAMAPTSLC5A1

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-117143062-B 4-Hydroxy-2-pyrone compound, preparation method and application 西北农林科技大学 2024-09-20 CN disclosed
CN-117143062-A 3-substituted 4-hydroxy-2-pyrone compound, preparation method and application 西北农林科技大学 2023-12-01 CN disclosed