SCHEMBL4125637

SCHEMBL4125637

O=C(O)c1ccc(/C=C2\SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 5/20 0.67
▸ DUSP22 Q9NRW4 1/20 0.67
▸ MEN1 O00255 2/20 0.66
▸ KMT2A Q03164 2/20 0.66
▸ CTDSP1 Q9GZU7 2/20 0.66
▸ POLB P06746 1/20 0.66
▸ BLM P54132 1/20 0.66
▸ NLRP3 Q96P20 4/20 0.66
▸ PTPN12 Q05209 3/20 0.64
▸ PTPN22 Q9Y2R2 3/20 0.64
▸ PTPN7 P35236 2/20 0.64
▸ GPR35 Q9HC97 2/20 0.64
▸ PSMD14 O00487 1/20 0.64
▸ MMP2 P08253 1/20 0.64
▸ GPR55 Q9Y2T6 1/20 0.64
▸ MAPK1 P28482 2/20 0.63
▸ HPGD P15428 1/20 0.56
▸ DDX3X O00571 1/20 0.55

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
SCHEMBL4125640 1.00 PTPN1 (0.67) PTPN1DUSP22MEN1KMT2ACTDSP1
SCHEMBL4125259 0.90 MEN1 (0.65) PTPN1DUSP22MEN1KMT2ACTDSP1
SCHEMBL4125257 0.90 MEN1 (0.65) PTPN1DUSP22MEN1KMT2ACTDSP1
SCHEMBL4138638 0.89 MAPK1 (0.72) MEN1KMT2ACTDSP1POLBBLM
SCHEMBL4138637 0.89 MAPK1 (0.72) MEN1KMT2ACTDSP1POLBBLM
SCHEMBL4132859 0.87 MAPK1 (0.63) PTPN1DUSP22MEN1KMT2ACTDSP1
SCHEMBL4132862 0.87 MAPK1 (0.63) PTPN1DUSP22MEN1KMT2ACTDSP1
SCHEMBL4126818 0.85 MEN1 (0.67) MEN1KMT2ACTDSP1POLBBLM
SCHEMBL4126817 0.85 MEN1 (0.67) MEN1KMT2ACTDSP1POLBBLM
SCHEMBL4141558 0.85 MAPT (0.64) DUSP22MEN1KMT2ACTDSP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247516-A1 3- (BENZO [D] [1,3] DIOXOL-5-YLMETHYL) -4- (THIO) OXO-2- (THIO) OXO-AZOLIDIN-5-YLIDENE DERIVATIVES AS ANTIBACTERIAL AGENTS KOTNIK MIHA 2009-10-01 — — US disclosed
US-20090247516-A1 3- (BENZO [D] [1,3] DIOXOL-5-YLMETHYL) -4- (THIO) OXO-2- (THIO) OXO-AZOLIDIN-5-YLIDENE DERIVATIVES AS ANTIBACTERIAL AGENTS KOTNIK MIHA 2009-10-01 — — US disclosed
EP-1916249-A1 3-(benzo[d][1,3]dioxol-5-ylmethyl)-4-(thio)oxo-2-(thio)oxo-azolidin-5-ylidene derivatives as antibacterial agents LEK Pharmaceuticals D.D. (SI) 2008-04-30 — — EP 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 (1 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-20090247516-A1 3- (BENZO [D] [1,3] DIOXOL-5-YLMETHYL) -4- (THIO) OXO-2- (THIO) OXO-AZOLIDIN-5-YLIDENE DERIVATIVES AS ANTIBACTERIAL AGENTS XDH, TXLNA, Q6ZSR9 PTPN1 114/4885DUSP22 4041/4885MEN1 2336/4885

“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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