SCHEMBL20869833

SCHEMBL20869833

O=C(CCCCC(=O)Oc1c(F)c(F)c(F)c(F)c1F)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ TSHR P16473 2/20 0.41
▸ KMT2A Q03164 6/20 0.40
▸ MEN1 O00255 5/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ POLB P06746 1/20 0.40
▸ UCHL1 P09936 1/20 0.40
▸ USP5 P45974 1/20 0.40
▸ USP4 Q13107 1/20 0.40
▸ SENP1 Q9P0U3 1/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ RECQL P46063 1/20 0.38
▸ PAM P19021 1/20 0.38
▸ CES2 O00748 1/20 0.38
▸ CES1 P23141 1/20 0.38
▸ AKR1B1 P15121 1/20 0.38

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
SCHEMBL6937307 0.82 SMN1; SMN2 (0.67) SMN1; SMN2L3MBTL1TSHRKMT2AMEN1
SCHEMBL20673370 0.82 ALDH1A1 (0.50) SMN1; SMN2L3MBTL1TDP1TSHRKMT2A
SCHEMBL26315892 0.81 ALDH1A1 (0.49) SMN1; SMN2L3MBTL1TDP1KMT2AMEN1
SCHEMBL22499185 0.80 TDP1 (0.58) SMN1; SMN2L3MBTL1TDP1TSHRKMT2A
SCHEMBL16217874 0.79 ALDH1A1 (0.50) SMN1; SMN2L3MBTL1TDP1TSHRKMT2A
SCHEMBL4953772 0.79 KMT2A (0.44) TSHRKMT2AMEN1KDM4EALDH1A1
SCHEMBL25495837 0.77 KMT2A (0.43) TSHRKMT2AMEN1KDM4EALDH1A1
SCHEMBL21049231 0.77 KMT2A (0.43) TSHRKMT2AMEN1KDM4EALDH1A1
SCHEMBL522462 0.77 KMT2A (0.43) TSHRKMT2AMEN1KDM4EALDH1A1
SCHEMBL31409726 0.76 KMT2A (0.41) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210009580-A1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS, INC. 2021-01-14 — — US disclosed
US-10815228-B2 Aztreonam derivatives and uses thereof ARIXA PHARMACEUTICALS, INC. (US) 2020-10-27 — — 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
US-20190100516-A1 AZTREONAM DERIVATIVES AND USES THEREOF ARIXA PHARMACEUTICALS, INC. 2019-04-04 — — 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-10280161-B2 Aztreonam derivatives and uses thereof MGAM, ABCG2, SI SMN1; SMN2 3921/4885L3MBTL1 2241/4885TDP1 2196/4885
US-20190211006-A1 AZTREONAM DERIVATIVES AND USES THEREOF MGAM, ABCG2, SI SMN1; SMN2 3921/4885L3MBTL1 2241/4885TDP1 2196/4885
US-20190100516-A1 AZTREONAM DERIVATIVES AND USES THEREOF MGAM, ABCG2, SI SMN1; SMN2 3921/4885L3MBTL1 2241/4885TDP1 2196/4885
US-10815228-B2 Aztreonam derivatives and uses thereof MGAM, ABCG2, SI SMN1; SMN2 3921/4885L3MBTL1 2241/4885TDP1 2196/4885
US-20210009580-A1 AZTREONAM DERIVATIVES AND USES THEREOF MGAM, ABCG2, SI SMN1; SMN2 3921/4885L3MBTL1 2241/4885TDP1 2196/4885

“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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