SCHEMBL20512155

SCHEMBL20512155

CC(=O)OCC(C)(C)Cc1ccccc1O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.42
▸ IDO1 P14902 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ HSPA5 P11021 1/20 0.38
▸ SERPINE1 P05121 1/20 0.38
▸ TYR P14679 1/20 0.37
▸ IAPP P10997 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.35

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
SCHEMBL29798814 1.00 AKR1B1 (0.42) AKR1B1IDO1ALDH1A1HSPA5SERPINE1
SCHEMBL28302378 0.84 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2TSHR
SCHEMBL2385885 0.79 ALDH1A1 (0.57) AKR1B1IDO1ALDH1A1HSPA5TYR
SCHEMBL17599139 0.78 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2CYP2D6TSHRHIF1A
Ammonia Solution, Strong SCHEMBL22266087 0.78 ALDH1A1 (0.55) AKR1B1IDO1ALDH1A1HSPA5TYR
SCHEMBL20673384 0.77 BACE1 (0.32) AKR1B1
Acetic Acid SCHEMBL7569175 0.76 ALDH1A1 (0.58) AKR1B1IDO1ALDH1A1HSPA5TYR
SCHEMBL674324 0.74 HSPA5 (0.54) AKR1B1IDO1ALDH1A1HSPA5CYP2D6
SCHEMBL20512217 0.73 HSPA5 (0.48) AKR1B1IDO1ALDH1A1HSPA5CYP2D6
SCHEMBL10850944 0.73 HSPA5 (0.48) AKR1B1IDO1ALDH1A1HSPA5CYP2D6

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240415847-A1 BETA-LACTAMASE INHIBITORS AND USES THEREOF ARIXA PHARMACEUTICALS, INC. (US) 2024-12-19 — — US disclosed
EP-3860999-B9 DERIVATIVES OF RELEBACTAM AND USES THEREOF ARIXA PHARMACEUTICALS INC (US) 2024-08-14 — — EP disclosed
EP-3860999-B1 DERIVATIVES OF RELEBACTAM AND USES THEREOF ARIXA PHARMACEUTICALS INC (US) 2024-06-05 — — EP disclosed
EP-3625233-B9 3-(((((2S,5R)-2-CARBAMOYL-7-OXO-1,6-DIAZABICYCLO[3.2.1]OCTAN-6-YL)OXY)SULFONYL)OXY)-2,2-DIMETHYLPROPANOATE DERIVATIVES AND RELATED COMPOUNDS AS PERORALLY ADMINISTERED PROFRUGS OF BETA-LACTAMASE INHIBITORS FOR TREATING BACTERIAL INFECTIONS ARIXA PHARMACEUTICALS INC (US) 2023-10-25 — — EP disclosed
EP-3625233-B9 3-(((((2S,5R)-2-CARBAMOYL-7-OXO-1,6-DIAZABICYCLO[3.2.1]OCTAN-6-YL)OXY)SULFONYL)OXY)-2,2-DIMETHYLPROPANOATE DERIVATIVES AND RELATED COMPOUNDS AS PERORALLY ADMINISTERED PROFRUGS OF BETA-LACTAMASE INHIBITORS FOR TREATING BACTERIAL INFECTIONS ARIXA PHARMACEUTICALS INC (US) 2023-10-25 — — EP disclosed
EP-3625233-B1 3-(((((2S,5R)-2-CARBAMOYL-7-OXO-1,6-DIAZABICYCLO[3.2.1]OCTAN-6-YL)OXY)SULFONYL)OXY)-2,2-DIMETHYLPROPANOATE DERIVATIVES AND RELATED COMPOUNDS AS PERORALLY ADMINISTERED PROFRUGS OF BETA-LACTAMASE INHIBITORS FOR TREATING BACTERIAL INFECTIONS ARIXA PHARMACEUTICALS INC (US) 2023-07-12 — — EP disclosed
EP-3625233-B1 3-(((((2S,5R)-2-CARBAMOYL-7-OXO-1,6-DIAZABICYCLO[3.2.1]OCTAN-6-YL)OXY)SULFONYL)OXY)-2,2-DIMETHYLPROPANOATE DERIVATIVES AND RELATED COMPOUNDS AS PERORALLY ADMINISTERED PROFRUGS OF BETA-LACTAMASE INHIBITORS FOR TREATING BACTERIAL INFECTIONS ARIXA PHARMACEUTICALS INC (US) 2023-07-12 — — EP disclosed
US-20230201218-A1 BETA-LACTAMASE INHIBITORS AND USES THEREOF ARIXA PHARMACEUTICALS, INC. (US) 2023-06-29 — — US disclosed
US-20230201218-A1 BETA-LACTAMASE INHIBITORS AND USES THEREOF ARIXA PHARMACEUTICALS, INC. (US) 2023-06-29 — — US disclosed
EP-3676247-B1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS INC (US) 2023-03-08 — — EP disclosed
US-10500211-B2 Beta-lactamase inhibitors and uses thereof ARIXA PHARMACEUTICALS, INC. (US) 2019-12-10 — — US disclosed
US-20190211006-A1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS, INC. 2019-07-11 — — US disclosed
US-20190211006-A1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS, INC. 2019-07-11 — — US disclosed
US-10280161-B2 Aztreonam derivatives and uses thereof ARIXA PHARMACEUTICALS, INC. (US) 2019-05-07 — — US disclosed
WO-2019070595-A1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS, INC. (US) 2019-04-11 — — WO disclosed
WO-2019070595-A1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS, INC. (US) 2019-04-11 — — WO disclosed
US-20190100516-A1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS, INC. 2019-04-04 — — US disclosed
US-20190022102-A1 BETA-LACTAMASE INHIBITORS AND USES THEREOF ARIXA PHARMACEUTICALS, INC. 2019-01-24 — — US disclosed
WO-2018208557-A1 3-(((((2S,5R)-2-CARBAMOYL-7-OXO-1,6-DIAZABICYCLO[3.2.1]OCTAN-6-YL)OXY)SULFONYL)OXY)-2,2-DIMETHYLPROP NOATE DERIVATIVES AND RELATED COMPOUNDS AS PERORALLY ADMINISTERED PROFRUGS OF BETA-LACTAMASE INHIBITORS FOR TREATING BACTERIAL INFECTIONS ARIXA PHARMACEUTICALS, INC. (US) 2018-11-15 — — WO disclosed
US-10085999-B1 Beta-lactamase inhibitors and uses thereof ARIXA PHARMACEUTICALS, INC. (US) 2018-10-02 — — 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 (8 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-10280161-B2 Aztreonam derivatives and uses thereof MGAM, ABCG2, SI AKR1B1 1122/4885IDO1 2883/4885ALDH1A1 1229/4885
US-20190211006-A1 AZTREONAM DERIVATIVES AND USES THEREOF MGAM, ABCG2, SI AKR1B1 1122/4885IDO1 2883/4885ALDH1A1 1229/4885
US-20190022102-A1 BETA-LACTAMASE INHIBITORS AND USES THEREOF MGAM, LCT, CMBL AKR1B1 2207/4885IDO1 2786/4885ALDH1A1 834/4885
US-20190100516-A1 AZTREONAM DERIVATIVES AND USES THEREOF MGAM, ABCG2, SI AKR1B1 1122/4885IDO1 2883/4885ALDH1A1 1229/4885
US-20230201218-A1 BETA-LACTAMASE INHIBITORS AND USES THEREOF GAA, LCT, MGAM AKR1B1 1770/4885IDO1 2242/4885ALDH1A1 830/4885
US-10085999-B1 Beta-lactamase inhibitors and uses thereof GAA, LCT, MGAM AKR1B1 1770/4885IDO1 2242/4885ALDH1A1 830/4885
US-10500211-B2 Beta-lactamase inhibitors and uses thereof GAA, LCT, MGAM AKR1B1 1770/4885IDO1 2242/4885ALDH1A1 830/4885
US-20240415847-A1 BETA-LACTAMASE INHIBITORS AND USES THEREOF GAA, LCT, MGAM AKR1B1 1770/4885IDO1 2242/4885ALDH1A1 830/4885

“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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