Alpha-Naphthylacetate

Alpha-Naphthylacetate

SCHEMBL8749472

C1COO1.CC(=O)Oc1cccc2ccccc12

nearest known ligand 0.57

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
HSD17B10 Q99714 4/20 0.57
PTGS1 P23219 2/20 0.57
PGR P06401 1/20 0.57
GAA P10253 1/20 0.57
MAPK1 P28482 1/20 0.57
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
RAB9A P51151 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MMP2 P08253 1/20 0.49
KDM4E B2RXH2 4/20 0.47
HPGD P15428 3/20 0.47
TDP1 Q9NUW8 2/20 0.46
ESR1 P03372 1/20 0.46
ITGB3 P05106 1/20 0.46
ITGA2B P08514 1/20 0.46
HMGB1 P09429 1/20 0.46
TSHR P16473 1/20 0.46
GGT1 P19440 1/20 0.46

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
Alpha-Naphthylacetate SCHEMBL8749464 0.92 ALDH1A1 (0.55) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL76633 0.91 ALDH1A1 (0.66) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL29372782 0.91 ALDH1A1 (0.66) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL10751544 0.90 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL15903555 0.90 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL11320989 0.90 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL14715837 0.90 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL14715880 0.90 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL10751537 0.90 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1PGRGAA
Alpha-Naphthylacetate SCHEMBL28643889 0.90 ALDH1A1 (0.64) ALDH1A1HSD17B10PTGS1PGRGAA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0416038-B1 NOVEL CHEMILUMINESCENT FUSED POLYCYCLIC RING-CONTAINING 1,2-DIOXETANES AND ASSAYS IN WHICH THEY ARE USED TROPIX INC (US) 1997-03-26 EP disclosed
EP-0416038-A4 NOVEL CHEMILUMINESCENT FUSED POLYCYCLIC RING-CONTAINING 1,2-DIOXETANES AND ASSAYS IN WHICH THEY ARE USED 1992-02-26 EP disclosed
EP-0416038-A1 NOVEL CHEMILUMINESCENT FUSED POLYCYCLIC RING-CONTAINING 1,2-DIOXETANES AND ASSAYS IN WHICH THEY ARE USED. TROPIX INC (US) 1991-03-13 EP disclosed
US-4952707-A DECOMPOSITION TO LIGHT EMITTING FLUOROPHORE; ANALYSIS TROPIX, INC. (US) 1990-08-28 US disclosed
WO-1990000164-A1 NOVEL CHEMILUMINESCENT FUSED POLYCYCLIC RING-CONTAINING 1,2-DIOXETANES AND ASSAYS IN WHICH THEY ARE USED TROPIX, INC. (US) 1990-01-11 WO disclosed