Aurantiamide Acetate

Aurantiamide Acetate

SCHEMBL4357298

CC(=O)OC[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1

nearest known ligand 0.71

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 7/20 0.71
▸ CTSS P25774 3/20 0.57
▸ CTSK P43235 3/20 0.57
▸ PIN1 Q13526 1/20 0.55
▸ PSMB5 P28074 2/20 0.55
▸ TACR1 P25103 1/20 0.52
▸ CTRB1 P17538 1/20 0.51
▸ CTSB P07858 2/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ GAA P10253 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ GPR139 Q6DWJ6 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ GLA P06280 1/20 0.49

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
Aurantiamide Acetate SCHEMBL30004267 1.00 CTSL (0.71) CTSLCTSSCTSKPIN1PSMB5
Aurantiamide Acetate SCHEMBL31084254 1.00 CTSL (0.71) CTSLCTSSCTSKPIN1PSMB5
Aurantiamide Acetate SCHEMBL30532189 1.00 CTSL (0.71) CTSLCTSSCTSKPIN1PSMB5
Aurantiamide Acetate SCHEMBL27679112 1.00 CTSL (0.71) CTSLCTSSCTSKPIN1PSMB5
SCHEMBL24368215 0.93 CTSL (0.63) CTSLCTSSCTSKPIN1PSMB5
SCHEMBL24368216 0.93 CTSL (0.63) CTSLCTSSCTSKPIN1PSMB5
SCHEMBL24368196 0.92 CTSL (0.61) CTSLCTSSCTSKPIN1PSMB5
SCHEMBL24368183 0.92 CTSL (0.61) CTSLCTSSCTSKPIN1PSMB5
SCHEMBL28530796 0.92 CTSL (0.61) CTSLCTSSCTSKPIN1PSMB5
SCHEMBL4366379 0.92 CTSL (0.60) CTSLCTSSCTSKPIN1PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247470-A1 PHENYLALANINE DIPEPTIDE DERIVATIVES, COMPOSITIONS AND USE THEREOF The Key Lab. Of Chemistry for Natural Products of Guizhou Province and Chinese Acad. of Sciences (CN) 2009-10-01 — — US claimed
CN-118453623-A Application of alisol B in preventing and treating central precocity 俞建 2024-08-09 — — CN disclosed
CN-115650875-B Zantedeschia aethiopica derivative and preparation method and application thereof 贵州省天然产物研究中心 2024-05-14 — — CN disclosed
CN-112500308-B Golden amide alcohol ester and fluorinated derivative thereof, and preparation method and application thereof 澳门科技大学 2023-10-03 — — CN disclosed
CN-111909051-B N- [ 4-phenyl-3- (benzoylamino) -1, 1-trifluoro-butyl-2-yl ] -phenylalaninol derivative and preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2022-12-27 — — CN disclosed
US-11377418-B2 Compounds and methods for treating influenza MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (MO) 2022-07-05 — — US disclosed
US-20220127220-A1 COMPOUNDS AND METHODS FOR TREATING INFLUENZA MACAU UNIVERSITY OF SCIENCE AND TECHNOLOGY (MO) 2022-04-28 — — US disclosed
CN-111909051-A N- [ 4-phenyl-3- (benzoylamino) -1,1, 1-trifluoro-butyl-2-yl ] -phenylalaninol derivative and preparation method and application thereof 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) 2020-11-10 — — CN disclosed
US-9023809-B2 Phenylalanine dipeptide derivatives, compositions and use thereof THE KEY LABORATORY OF CHEMISTRY FOR NATURAL PRODUCTS OF GUIZHOU PROVINCE AND CHINESE ACADEMY OF SCIENCES (CN) 2015-05-05 — — US disclosed
US-20090247470-A1 PHENYLALANINE DIPEPTIDE DERIVATIVES, COMPOSITIONS AND USE THEREOF The Key Lab. Of Chemistry for Natural Products of Guizhou Province and Chinese Acad. of Sciences (CN) 2009-10-01 — — 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 (3 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-20090247470-A1 PHENYLALANINE DIPEPTIDE DERIVATIVES, COMPOSITIONS AND USE THEREOF DNPEP, PEPD, VIP CTSL 591/4885CTSS 3153/4885CTSK 2637/4885
US-20220127220-A1 COMPOUNDS AND METHODS FOR TREATING INFLUENZA H1-3, HRH3, H1-4 CTSL 1708/4885CTSS 1088/4885CTSK 1076/4885
US-11377418-B2 Compounds and methods for treating influenza H1-3, HRH3, H1-4 CTSL 1708/4885CTSS 1088/4885CTSK 1076/4885

“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.

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