SCHEMBL4401957

SCHEMBL4401957

O=C(Nc1ccc(C(=O)O)cc1)ON1C(=O)CCC1=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA9 Q16790 1/20 0.47
MITF O75030 1/20 0.45
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 1/20 0.44
HPGD P15428 1/20 0.43
POLB P06746 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
FFAR1 O14842 1/20 0.41
EPHX2 P34913 3/20 0.40
FAAH O00519 1/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PTPN11 Q06124 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
KDM4E B2RXH2 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL4402097 0.86 SMN1; SMN2 (0.49) ALDH1A1HPGDPOLBMEN1KMT2A
SCHEMBL1205198 0.85 SMN1; SMN2 (0.51) ALDH1A1MEN1KMT2AEPHX2LMNA
SCHEMBL9086106 0.84 GAA (0.44) CA12CA1CA9ALDH1A1HPGD
SCHEMBL14960465 0.84 HPGD (0.43) ALDH1A1HPGDMEN1KMT2AEPHX2
SCHEMBL22755094 0.84 ALDH1A1 (0.40) CA1CA9ALDH1A1HPGDMEN1
SCHEMBL4399509 0.83 NPC1 (0.54) ALDH1A1POLBLMNATDP1RAB9A
SCHEMBL4403971 0.82 ALDH1A1 (0.42) ALDH1A1HPGDMEN1KMT2ALMNA
SCHEMBL4401953 0.82 MEN1 (0.48) MITFALDH1A1MEN1KMT2ANR1H4
SCHEMBL10063822 0.81 ALDH1A1 (0.48) CA12CA1CA9MITFALDH1A1
SCHEMBL12995665 0.79 PSMB8 (0.46) CA12CA1CA9

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12092644-B2 Kits comprising aldehydes to reduce artifacts in analyzing glycans released from glycoproteins or glycopeptides AGILENT TECHNOLOGIES, INC. (US) 2024-09-17 US claimed
EP-3500842-B1 USE OF MILD ELECTROPHILES TO REDUCE ARTIFACTS IN ANALYZING GLYCANS RELEASED FROM GLYCOPROTEINS OR GLYCOPEPTIDES AGILENT TECHNOLOGIES INC (US) 2024-04-10 EP claimed
CN-108884030-B Improved labeling of nucleophiles using bipyridines 安捷伦科技有限公司 2022-06-28 CN claimed
US-20210333269-A1 Kits for Using Bispyridines to Improve Labeling of Nucleophiles AGILENT TECHNOLOGIES, INC. (US) 2021-10-28 US claimed
US-11035862-B2 Use of mild electrophiles to reduce artifacts in analyzing glycans released from glycoproteins or glycopeptides AGILENT TECHNOLOGIES, INC. (US) 2021-06-15 US claimed
EP-3500842-A1 USE OF MILD ELECTROPHILES TO REDUCE ARTIFACTS IN ANALYZING GLYCANS RELEASED FROM GLYCOPROTEINS OR GLYCOPEPTIDES Prozyme, Inc. (US) 2019-06-26 EP claimed
US-20190170763-A1 USE OF MILD ELECTROPHILES TO REDUCE ARTIFACTS IN ANALYZING GLYCANS RELEASED FROM GLYCOPROTEINS OR GLYCOPEPTIDES PROZYME, INC. (US) 2019-06-06 US claimed
WO-2018035271-A1 USE OF MILD ELECTROPHILES TO REDUCE ARTIFACTS IN ANALYZING GLYCANS RELEASED FROM GLYCOPROTEINS OR GLYCOPEPTIDES PROZYME, INC. (US) 2018-02-22 WO claimed
US-12092644-B2 Kits comprising aldehydes to reduce artifacts in analyzing glycans released from glycoproteins or glycopeptides AGILENT TECHNOLOGIES, INC. (US) 2024-09-17 US disclosed
EP-3500842-B1 USE OF MILD ELECTROPHILES TO REDUCE ARTIFACTS IN ANALYZING GLYCANS RELEASED FROM GLYCOPROTEINS OR GLYCOPEPTIDES AGILENT TECHNOLOGIES INC (US) 2024-04-10 EP disclosed
EP-3419963-B1 USE OF BISPYRIDINES TO IMPROVE LABELING OF NUCLEOPHILES AGILENT TECHNOLOGIES INC (US) 2022-08-10 EP disclosed
CN-108884030-B Improved labeling of nucleophiles using bipyridines 安捷伦科技有限公司 2022-06-28 CN disclosed
US-20210333269-A1 Kits for Using Bispyridines to Improve Labeling of Nucleophiles AGILENT TECHNOLOGIES, INC. (US) 2021-10-28 US disclosed
US-11092595-B2 Use of bispyridines to improve labeling of nucleophiles AGILENT TECHNOLOGIES, INC. (US) 2021-08-17 US disclosed
US-20120107942-A1 COMPOUNDS AND METHODS FOR RAPID LABELING OF N-GLYCANS PROZYME, INC. (US) 2012-05-03 US disclosed
US-8124792-B2 Compounds and methods for rapid labeling of N-glycans PROZYME, INC. (US) 2012-02-28 US disclosed
US-8124792-B2 Compounds and methods for rapid labeling of N-glycans PROZYME, INC. (US) 2012-02-28 US disclosed
US-20090258437-A1 COMPOUNDS AND METHODS FOR RAPID LABELING OF N-GLYCANS PROZYME, INC. (US) 2009-10-15 US disclosed
US-20090258437-A1 COMPOUNDS AND METHODS FOR RAPID LABELING OF N-GLYCANS PROZYME, INC. (US) 2009-10-15 US disclosed
WO-2009100155-A1 COMPOUNDS AND METHODS FOR RAPID LABELING OF N-GLYCANS PROZYME, INC. (US) 2009-08-13 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 (3 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-11092595-B2 Use of bispyridines to improve labeling of nucleophiles PTMS, BTD, DPYD CA12 3801/4885CA1 3538/4885CA9 3871/4885
US-20210333269-A1 Kits for Using Bispyridines to Improve Labeling of Nucleophiles DPYD, UNG, BTD CA12 3735/4885CA1 3292/4885CA9 2765/4885
US-20090258437-A1 COMPOUNDS AND METHODS FOR RAPID LABELING OF N-GLYCANS B3GNT2, FUT5, FUT6 CA12 75/4885CA1 307/4885CA9 171/4885

“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.