SCHEMBL850424

SCHEMBL850424

O=C(Nc1ccc2ncccc2c1)ON1C(=O)CCC1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.59
POLB P06746 2/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
MAPT P10636 1/20 0.59
PABPC1 P11940 1/20 0.53
RAB9A P51151 7/20 0.50
NOTUM Q6P988 1/20 0.48
ALDH1A1 P00352 4/20 0.48
CYP3A4 P08684 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
CYP1A2 P05177 1/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KDM4E B2RXH2 1/20 0.47
CYP2C19 P33261 1/20 0.47
OTUD7B Q6GQQ9 1/20 0.47

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
SCHEMBL29409612 1.00 NPC1 (0.59) NPC1POLBMEN1KMT2AMAPT
SCHEMBL13026244 0.92 NPC1 (0.53) NPC1POLBMEN1KMT2AMAPT
SCHEMBL22295267 0.82 NPC1 (0.52) NPC1POLBMEN1KMT2AMAPT
SCHEMBL4406274 0.81 KDM4E (0.46) NPC1POLBMEN1KMT2AMAPT
SCHEMBL3259839 0.80 ALDH1A1 (0.52) NPC1POLBMEN1KMT2AMAPT
SCHEMBL16264234 0.80 PLAU (0.38) NPC1POLBMEN1KMT2AMAPT
SCHEMBL16261009 0.79 ALOX15 (0.60) NPC1POLBMEN1KMT2AMAPT
SCHEMBL29033253 0.77 NPC1 (0.65) NPC1POLBMEN1KMT2AMAPT
SCHEMBL4401942 0.76 KMT2A (0.38) NPC1MEN1KMT2AMAPTRAB9A
SCHEMBL29986357 0.76 NPC1 (0.67) NPC1POLBMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4033223-B1 METHODS FOR THE RAPID PREPARATION OF LABELED GLYCOSYLAMINES AND FOR THE ANALYSIS OF GLYCOSYLATED BIOMOLECULES PRODUCING THE SAME WATERS TECHNOLOGIES CORP (US) 2025-06-18 EP disclosed
US-12158472-B2 Methods for the rapid preparation of labeled glycosylamines and for the analysis of glycosylated biomolecules producing the same WATERS TECHNOLOGIES CORPORATION (US) 2024-12-03 US disclosed
CN-118032958-A HPLC quantitative detection method of chondroitin sulfate based on GalN-AQC derivatization 中国检验检疫科学研究院 2024-05-14 CN disclosed
US-11747310-B2 Methods for liquid chromatography calibration for rapid labeled N-glycans WATERS TECHNOLOGIES CORPORATION (US) 2023-09-05 US disclosed
US-11747310-B2 Methods for liquid chromatography calibration for rapid labeled N-glycans WATERS TECHNOLOGIES CORPORATION (US) 2023-09-05 US disclosed
US-11747310-B2 Methods for liquid chromatography calibration for rapid labeled N-glycans WATERS TECHNOLOGIES CORPORATION (US) 2023-09-05 US disclosed
EP-3744708-B1 CALIBRANT FOR LIQUID CHROMATOGRAPHY CALIBRATION OF LABELED N-GLYCANS WATERS TECHNOLOGIES CORP (US) 2023-08-09 EP disclosed
EP-3744708-B1 CALIBRANT FOR LIQUID CHROMATOGRAPHY CALIBRATION OF LABELED N-GLYCANS WATERS TECHNOLOGIES CORP (US) 2023-08-09 EP disclosed
US-20220268779-A1 METHODS FOR THE RAPID PREPARATION OF LABELED GLYCOSYLAMINES AND FOR THE ANALYSIS OF GLYCOSYLATED BIOMOLECULES PRODUCING THE SAME WATERS TECHNOLOGIES CORPORATION (US) 2022-08-25 US disclosed
EP-4033223-A1 METHODS FOR THE RAPID PREPARATION OF LABELED GLYCOSYLAMINES AND FOR THE ANALYSIS OF GLYCOSYLATED BIOMOLECULES PRODUCING THE SAME Waters Technologies Corporation (US) 2022-07-27 EP disclosed
US-20160195564-A1 AUTOMATED SAMPLING AND REACTION SYSTEM FOR HIGH PRESSURE LIQUID CHROMATOGRAPHY AND OTHER TYPES OF DETECTION WATERS TECHNOLOGIES CORPORATION (US) 2016-07-07 US disclosed
WO-2016077548-A1 METHODS FOR LIQUID CHROMATOGRAPHY CALIBRATION FOR RAPID LABELED N-GLYCANS WATERS TECHNOLOGIES CORPORATION (US) 2016-05-19 WO disclosed
US-20130172528-A1 DALBAVANCIN COMPOSITIONS FOR TREATMENT OF BACTERIAL INFECTIONS VICURON PHARMACEUTICALS INC. 2013-07-04 US disclosed
US-20130102478-A1 INTERNAL STANDARDS AND METHODS FOR USE IN QUANTITATIVELY MEASURING ANALYTES IN A SAMPLE WATERS TECHNOLOGIES CORPORATION (US) 2013-04-25 US disclosed
US-20120184497-A1 DALBAVANCIN COMPOSITIONS FOR TREATMENT OF BACTERIAL INFECTIONS VICURON PHARMACEUTICALS INC. 2012-07-19 US disclosed
US-8143212-B2 Dalbavancin compositions for treatment of bacterial infections VICURON PHARMACEUTICALS INC. (US) 2012-03-27 US disclosed
US-8143212-B2 Dalbavancin compositions for treatment of bacterial infections VICURON PHARMACEUTICALS INC. (US) 2012-03-27 US disclosed
US-20090298749-A1 DALBAVANCIN COMPOSITIONS FOR TREATMENT OF BACTERIAL INFECTIONS VICURON PHARMACEUTICALS INC. 2009-12-03 US disclosed
US-20090298749-A1 DALBAVANCIN COMPOSITIONS FOR TREATMENT OF BACTERIAL INFECTIONS VICURON PHARMACEUTICALS INC. 2009-12-03 US disclosed
WO-2009070233-A1 INTERNAL STANDARDS AND METHODS FOR USE IN QUANTITATIVELY MEASURING ANALYTES IN A SAMPLE WATERS TECHNOLOGIES CORPORATION (US) 2009-06-04 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 (4 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-20130172528-A1 DALBAVANCIN COMPOSITIONS FOR TREATMENT OF BACTERIAL INFECTIONS PWWP2B, TREH, CUTA NPC1 3338/4885POLB 200/4885MEN1 2474/4885
US-20120184497-A1 DALBAVANCIN COMPOSITIONS FOR TREATMENT OF BACTERIAL INFECTIONS DAD1, CFB, STT3B NPC1 959/4885POLB 2692/4885MEN1 432/4885
US-20090298749-A1 DALBAVANCIN COMPOSITIONS FOR TREATMENT OF BACTERIAL INFECTIONS CUTA, MAGT1, C1S NPC1 1958/4885POLB 572/4885MEN1 469/4885
US-11747310-B2 Methods for liquid chromatography calibration for rapid labeled N-glycans DDOST, STT3B, CSGALNACT1 NPC1 2798/4885POLB 1377/4885MEN1 4442/4885

“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.