SCHEMBL4291447

SCHEMBL4291447

O=C1OCN(C(=O)OCc2ccccc2)[C@H]1CCI

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.63
PSEN1 P49768 1/20 0.48
PSEN2 P49810 1/20 0.48
APH1B Q8WW43 1/20 0.48
NCSTN Q92542 1/20 0.48
APH1A Q96BI3 1/20 0.48
PSENEN Q9NZ42 1/20 0.48
F2 P00734 2/20 0.43
ELANE P08246 2/20 0.43
CTSG P08311 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTR2C P28335 1/20 0.41
PREP P48147 1/20 0.41

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
SCHEMBL4291455 1.00 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL8978452 0.90 USP2 (0.65) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL6965437 0.89 USP2 (0.64) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711284 0.88 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL3184957 0.88 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711299 0.88 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL8842431 0.88 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL8842606 0.88 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5218306 0.87 USP2 (0.62) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5218287 0.87 USP2 (0.62) USP2PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8344115-B2 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2013-01-01 US disclosed
US-8344115-B2 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2013-01-01 US disclosed
US-8344115-B2 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2013-01-01 US disclosed
WO-2009131643-A1 IMMUNOASSAY FOR SPECIFIC DETERMINATION OF S-ADENOSYMETHIONINE AND ANALOGS THEREOF IN BIOLOGICAL SAMPLES MONABIO, INC. (US) 2009-10-29 WO disclosed
WO-2009131643-A1 IMMUNOASSAY FOR SPECIFIC DETERMINATION OF S-ADENOSYMETHIONINE AND ANALOGS THEREOF IN BIOLOGICAL SAMPLES MONABIO, INC. (US) 2009-10-29 WO disclosed
US-20090263879-A1 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2009-10-22 US disclosed
US-20090263879-A1 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2009-10-22 US disclosed
US-20090263879-A1 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2009-10-22 US disclosed
US-5633385-A Optically active ω-halo-2-amino-alkanecarboxylic acid derivatives, process for the preparation thereof and their use for the preparation of optically active phosphorus-containing α-amino acids HOECHST SCHERING AGREVO GMBH (DE) 1997-05-27 US disclosed
US-5591861-A Optically active ω-halo-2-amino-alkanecarboxylic acid derivatives, process for the preparation thereof and their use for the preparation of optically active phosphorus-containing α-amino acids HOECHST AKTIENGESELLSCHAFT (DE) 1997-01-07 US disclosed
EP-0530506-B1 Optically active omega-halogen-2-amino alkanoic acids derivatives, process for their preparation and their use for the preparation of optically active phosphor-containing alpha-aminoacids HOECHST SCHERING AGREVO GMBH (DE) 1996-05-01 EP disclosed
EP-0530506-A1 Optically active omega-halogen-2-amino alkanoic acids derivatives, process for their preparation and their use for the preparation of optically active phosphor-containing alpha-aminoacids Hoechst Schering AgrEvo GmbH (DE) 1993-03-10 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-20090263879-A1 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples AHCY, MAT2A, MAT1A USP2 1577/4885PSEN1 4472/4885PSEN2 4463/4885

“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.