SCHEMBL6502279

SCHEMBL6502279

O=C(O)CCCNC(=O)C1CCCCCC1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.62
EPHX2 P34913 2/20 0.60
KEAP1 Q14145 1/20 0.54
NFE2L2 Q16236 1/20 0.54
EPHX1 P07099 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
PKM P14618 1/20 0.49
RAB9A P51151 1/20 0.49
ITGB3 P05106 4/20 0.47
ITGA2B P08514 4/20 0.47
ALDH1A1 P00352 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
NAMPT P43490 1/20 0.44
DRD2 P14416 1/20 0.44
DRD3 P35462 1/20 0.44
F2R P25116 1/20 0.44

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
SCHEMBL2678008 1.00 NAAA (0.62) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL5902012 0.98 NAAA (0.59) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL9829575 0.95 NAAA (0.65) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL7897834 0.93 NAAA (0.68) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL5655426 0.93 NAAA (0.68) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL9831292 0.93 NAAA (0.62) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL9830181 0.91 NAAA (0.65) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL2331473 0.90 EPHX2 (0.51) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL9951287 0.89 NAAA (0.56) NAAAEPHX2KEAP1NFE2L2EPHX1
SCHEMBL19359643 0.89 NAAA (0.56) NAAAEPHX2KEAP1NFE2L2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220133685-A1 FAST-ACTING PLANT-BASED MEDICINAL COMPOUNDS AND NUTRITIONAL SUPPLEMENTS RECEPTOR HOLDINGS, INC. (US) 2022-05-05 US disclosed
US-11246852-B2 Fast-acting plant-based medicinal compounds and nutritional supplements RECEPTOR HOLDINGS, INC. (US) 2022-02-15 US disclosed
US-20210393575-A1 N-ACYLATED FATTY AMINO ACIDS TO REDUCE ABSORPTION VARIABILITY IN CANNABINOID BASED COMPOSITIONS RECEPTOR HOLDINGS, INC. (US) 2021-12-23 US disclosed
US-20200101034-A1 RAPID AND CONTROLLED DELIVERY OF COMPOSITIONS WITH RESTORED ENTOURAGE EFFECTS RECEPTOR HOLDINGS, INC. (US) 2020-04-02 US disclosed
US-7417022-B2 Compounds and compositions for delivering active agents MHR INSTITUTIONAL PARTNERS IIA LP (US) 2008-08-26 US disclosed
US-7417022-B2 Compounds and compositions for delivering active agents MHR INSTITUTIONAL PARTNERS IIA LP (US) 2008-08-26 US disclosed
EP-1792624-A1 Modified amino acids and compositions comprising them for delivering active agents Emisphere Technologies, Inc. (US) 2007-06-06 EP disclosed
US-6878708-B2 Imidazotriazinones and the use thereof BAYER AKTIENGESELLSCHAFT (DE) 2005-04-12 US disclosed
US-20040097498-A1 Novel imidazotriazinones and the use thereof BAYER AKTIENGESELLSCHAFT (DE) 2004-05-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040097498-A1 Novel imidazotriazinones and the use thereof CYP4F3, CYP4F2, CYP3A7 NAAA 3998/4885EPHX2 2796/4885KEAP1 2014/4885
US-11246852-B2 Fast-acting plant-based medicinal compounds and nutritional supplements SLC1A5, SLC43A1, SLC27A2 NAAA 152/4885EPHX2 4247/4885KEAP1 1617/4885
US-20200101034-A1 RAPID AND CONTROLLED DELIVERY OF COMPOSITIONS WITH RESTORED ENTOURAGE EFFECTS FABP2, ASS1, AADAT NAAA 88/4885EPHX2 2470/4885KEAP1 4387/4885
US-20210393575-A1 N-ACYLATED FATTY AMINO ACIDS TO REDUCE ABSORPTION VARIABILITY IN CANNABINOID BASED COMPOSITIONS FAAH, CNR2, FABP2 NAAA 39/4885EPHX2 1872/4885KEAP1 4222/4885
US-20220133685-A1 FAST-ACTING PLANT-BASED MEDICINAL COMPOUNDS AND NUTRITIONAL SUPPLEMENTS SLC1A5, SLC43A1, SLC27A2 NAAA 152/4885EPHX2 4247/4885KEAP1 1617/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.