SCHEMBL22452269

SCHEMBL22452269

CCOC(=O)c1csc(C(=O)CCCCc2ccc(-c3cccc(OC(=O)c4csc(C(=O)CCCCc5ccc(-c6ccccc6)cc5)n4)c3)cc2)n1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 2/20 0.54
MAPT P10636 1/20 0.48
MMP1 P03956 1/20 0.45
MMP13 P45452 1/20 0.45
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 2/20 0.41
CES1 P23141 3/20 0.41
FAAH O00519 1/20 0.40
DAGLA Q9Y4D2 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HSP90AA1 P07900 1/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 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
SCHEMBL17368809 0.91 PLA2G4A (0.61) PLA2G4AMAPTMMP1MMP13RAB9A
SCHEMBL1667463 0.85 PLA2G4A (0.62) PLA2G4AMAPTRAB9ASMN1; SMN2NPC1
SCHEMBL12548644 0.81 CES1 (0.56) PLA2G4ACES1FAAHDAGLA
SCHEMBL12548449 0.78 PLA2G4A (0.59) PLA2G4AMMP1MMP13CES1FAAH
SCHEMBL1667502 0.76 ALDH1A1 (0.48) MAPTLMNA
SCHEMBL20662520 0.73 PLA2G4A (0.68) PLA2G4AMAPTRAB9ASMN1; SMN2NPC1
SCHEMBL17368814 0.72 DAGLA (0.69) CES1DAGLA
SCHEMBL1667122 0.72 PLA2G4A (0.71) PLA2G4AMAPTRAB9ASMN1; SMN2NPC1
SCHEMBL20814646 0.71 PLA2G4A (1.00) PLA2G4AMAPTRAB9ASMN1; SMN2NPC1
SCHEMBL1667949 0.71 PLA2G4A (0.64) PLA2G4AMAPTCES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691959-B2 Anti-inflammatory and antitumor 2-oxothiazoles and 2-oxothiophenes compounds AVEXXIN AS (NO) 2023-07-04 US disclosed
US-20220363659-A1 ANTI-INFLAMMATORY AND ANTITUMOR 2-OXOTHIAZOLES AND 2-OXOTHIOPHENES COMPOUNDS AVEXXIN AS (NO) 2022-11-17 US disclosed
US-11034666-B2 Anti-inflammatory and antitumor 2-oxothiazoles and 2-oxothiophenes compounds AVEXXIN AS (NO) 2021-06-15 US disclosed
US-20200299256-A1 ANTI-INFLAMMATORY AND ANTITUMOR 2-OXOTHIAZOLES AND 2-OXOTHIOPHENES COMPOUNDS AVEXXIN AS (NO) 2020-09-24 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 (4 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-11034666-B2 Anti-inflammatory and antitumor 2-oxothiazoles and 2-oxothiophenes compounds CASP1, OXER1, IL1B PLA2G4A 1499/4885MAPT 2758/4885MMP1 999/4885
US-20200299256-A1 ANTI-INFLAMMATORY AND ANTITUMOR 2-OXOTHIAZOLES AND 2-OXOTHIOPHENES COMPOUNDS CASP1, OXER1, IL1B PLA2G4A 1553/4885MAPT 2723/4885MMP1 986/4885
US-20220363659-A1 ANTI-INFLAMMATORY AND ANTITUMOR 2-OXOTHIAZOLES AND 2-OXOTHIOPHENES COMPOUNDS OXER1, CASP1, IL6 PLA2G4A 1539/4885MAPT 2883/4885MMP1 1017/4885
US-11691959-B2 Anti-inflammatory and antitumor 2-oxothiazoles and 2-oxothiophenes compounds CASP1, IL1B, OXER1 PLA2G4A 1579/4885MAPT 2844/4885MMP1 978/4885

“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.