SCHEMBL4131316

SCHEMBL4131316

O=C1SC(=Cc2cccc(O)c2)C(=O)N1Cc1ccc2c(c1)OCO2

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.65
▸ ACP1 P24666 4/20 0.65
▸ AKR1B1 P15121 1/20 0.57
▸ KMT2A Q03164 3/20 0.56
▸ MITF O75030 1/20 0.56
▸ MEN1 O00255 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ MAPK1 P28482 1/20 0.52
▸ ENPP2 Q13822 3/20 0.51
▸ PIM1 P11309 1/20 0.49
▸ CFTR P13569 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ CA9 Q16790 1/20 0.49
▸ CMA1 P23946 1/20 0.48

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
SCHEMBL4131315 1.00 PTPN1 (0.65) PTPN1ACP1AKR1B1KMT2AMITF
SCHEMBL4125372 0.90 MEN1 (0.69) PTPN1ACP1KMT2AMEN1ATM
SCHEMBL4125376 0.90 MEN1 (0.69) PTPN1ACP1KMT2AMEN1ATM
SCHEMBL4125367 0.90 MEN1 (0.69) PTPN1ACP1KMT2AMEN1ATM
SCHEMBL4132059 0.84 MAPK1 (0.65) AKR1B1KMT2AMEN1MAPK1PKM
SCHEMBL13651178 0.84 MAPK1 (0.65) AKR1B1KMT2AMEN1MAPK1PKM
SCHEMBL4132061 0.84 MAPK1 (0.65) AKR1B1KMT2AMEN1MAPK1PKM
SCHEMBL13651179 0.80 KMT2A (0.50) PTPN1ACP1KMT2AMEN1ATM
SCHEMBL4132105 0.80 KMT2A (0.50) PTPN1ACP1KMT2AMEN1ATM
SCHEMBL4132107 0.80 KMT2A (0.50) PTPN1ACP1KMT2AMEN1ATM

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
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
WO-2008043733-A1 3- (BENZO [D] [1,3] DIOXOL-5-YLMETHYL) -4- (THIO) OXO-2- (THIO) OXO-AZOLIDIN-5-YLIDENE DERIVATIVES AS ANTIBACTERIAL AGENTS LEK PHARMACEUTICAL D.D. (SI) 2008-04-17 — — WO 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 114/4885ACP1 2756/4885AKR1B1 1329/4885

“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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