SCHEMBL4013498

SCHEMBL4013498

O=C1CNC(=O)N1Cc1ccc2c(c1)OCCO2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.55
GSK3A P49840 1/20 0.54
GSK3B P49841 1/20 0.54
KMT2A Q03164 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
PKM P14618 2/20 0.49
TSHR P16473 2/20 0.49
CYP2D6 P10635 1/20 0.48
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
MEN1 O00255 2/20 0.42
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90B1 P14625 1/20 0.41
TRAP1 Q12931 1/20 0.41
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL4013109 0.79 CMA1 (0.62) CMA1KMT2ASMN1; SMN2PKMTSHR
SCHEMBL6944267 0.75 KMT2A (0.83) CMA1KMT2ASMN1; SMN2PKMTSHR
SCHEMBL4016556 0.75 POLB (0.54) CMA1KMT2ASMN1; SMN2PKMTSHR
SCHEMBL30968923 0.74 GSK3A (0.58) GSK3AGSK3BKMT2ASMN1; SMN2TSHR
SCHEMBL5182321 0.73 GSK3A (0.66) GSK3AGSK3BKMT2ASMN1; SMN2TSHR
SCHEMBL8079266 0.73 GSK3A (0.66) GSK3AGSK3BKMT2ASMN1; SMN2PKM
SCHEMBL6293317 0.73 KMT2A (0.73) GSK3AGSK3BKMT2ASMN1; SMN2TSHR
SCHEMBL5768481 0.72 CMA1 (0.76) CMA1KMT2ASMN1; SMN2PKMTSHR
SCHEMBL8320050 0.71 SMN1; SMN2 (0.73) GSK3AGSK3BKMT2ASMN1; SMN2TSHR
SCHEMBL5311390 0.71 GSK3A (0.69) GSK3AGSK3BKMT2ASMN1; SMN2TSHR

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-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-2074124-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) 2009-07-01 EP 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 CMA1 3946/4885GSK3A 4065/4885GSK3B 4015/4885

“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.