SCHEMBL1823926

SCHEMBL1823926

NC1OB(O)c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KLK1 P06870 5/20 0.47
KLK5 Q9Y337 6/20 0.44
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
KLK8 O60259 1/20 0.32
F2 P00734 1/20 0.32
PLAU P00749 1/20 0.32
KLKB1 P03952 1/20 0.32
ELANE P08246 1/20 0.32
KLK14 Q9P0G3 1/20 0.32
ST14 Q9Y5Y6 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM1A O60341 1/20 0.31

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
Hydrochloric Acid SCHEMBL19838193 0.98 KLK1 (0.50) KLK1KLK5CA1CA2CA12
SCHEMBL10268054 0.77 KLK1 (0.45) KLK1KLK5CA1CA2CA12
SCHEMBL12475273 0.76 KLK1 (0.56) KLK1KLK5KLK8F2PLAU
SCHEMBL12475533 0.76 KLK1 (0.56) KLK1KLK5KLK8F2PLAU
SCHEMBL1135209 0.76 KLK1 (0.56) KLK1KLK5KLK8F2PLAU
SCHEMBL19647568 0.75 KLK1 (0.44) KLK1KLK5CA1CA2CA12
SCHEMBL8076597 0.75 KLK1 (0.44) KLK1KLK5CA1CA2CA12
SCHEMBL17837011 0.75 KLK1 (0.44) KLK1KLK5CA1CA2CA12
SCHEMBL17981792 0.75 KLK1 (0.44) KLK1KLK5CA1CA2CA12
Hydrochloric Acid SCHEMBL3446642 0.75 KLK1 (0.58) KLK1KLK5KLK8F2PLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113735992-B Method for crosslinking glycosaminoglycans 国家科学研究中心 2023-12-05 CN disclosed
US-11807726-B2 Method of crosslinking glycosaminoglycans CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2023-11-07 US disclosed
EP-4249492-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND ANTIBIOTIC COMPOSITION COMPRISING SAME A&J Science Co.,Ltd. (KR) 2023-09-27 EP disclosed
US-20220081519-A1 METHOD OF CROSSLINKING GLYCOSAMINOGLYCANS GALDERMA RESEARCH & DEVELOPMENT (FR) 2022-03-17 US disclosed
US-11214655-B2 Method of crosslinking glycosaminoglycans GALDERMA RESEARCH & DEVELOPMENT (FR) 2022-01-04 US disclosed
CN-113735992-A Method for cross-linking glycosaminoglycans 高德美研究及发展公司 2021-12-03 CN disclosed
EP-3736296-B1 METHOD OF CROSSLINKING GLYCOSAMINOGLYCANS GALDERMA RES & DEV (FR) 2021-09-15 EP disclosed
CN-110023341-B Method for cross-linking glycosaminoglycans 高德美研究及发展公司 2021-06-25 CN disclosed
US-20210154317-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS ARS Pharmaceuticals, Inc. 2021-05-27 US disclosed
EP-3736296-A1 METHOD OF CROSSLINKING GLYCOSAMINOGLYCANS Galderma Research & Development (FR) 2020-11-11 EP disclosed
US-20110212918-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
US-20110207702-A1 BORON-CONTAINING SMALL MOLECULES AS ANTI-PROTOZOAL AGENTS ANACOR PHARMACEUTICALS, INC. (US) 2011-08-25 US disclosed
US-20110172187-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2011-07-14 US disclosed
WO-2011060199-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2011-05-19 WO disclosed
WO-2011060196-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2011-05-19 WO disclosed
US-20100292504-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
US-20100292504-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2010-11-18 US disclosed
US-7816344-B2 oxaboroles such as 3-[[(3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl]oxy]propan-1-ol, useful for treating bacterial infections; microbiocides; antibiotics ANACOR PHARMACEUTICALS, INC. (US) 2010-10-19 US disclosed
US-20100256092-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2010-10-07 US disclosed
US-20090227541-A1 oxaboroles such as 3-[[(3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl]oxy]propan-1-ol, useful for treating bacterial infections; microbiocides; antibiotics ANACOR PHARMACEUTICALS, INC. (US) 2009-09-10 US 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 (10 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-20110212918-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BCL6, BTD KLK1 1578/4885KLK5 1864/4885CA1 4452/4885
US-20210154317-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS HAVCR2, FCGR3B, FCGR1A KLK1 1889/4885KLK5 2237/4885CA1 3275/4885
US-20100292504-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BLVRB, BCL6 KLK1 2138/4885KLK5 2673/4885CA1 3768/4885
US-20110172187-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BCL6, BTD KLK1 1578/4885KLK5 1864/4885CA1 4452/4885
US-20220081519-A1 METHOD OF CROSSLINKING GLYCOSAMINOGLYCANS CD44, HPSE, CSGALNACT1 KLK1 1271/4885KLK5 2545/4885CA1 1113/4885
US-20090227541-A1 oxaboroles such as 3-[[(3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl]oxy]propan-1-ol, useful for treating bacterial infections; microbiocides; antibiotics OXA1L, TLR1, OXER1 KLK1 925/4885KLK5 2164/4885CA1 4867/4885
US-11214655-B2 Method of crosslinking glycosaminoglycans CD44, HPSE, CSGALNACT1 KLK1 1271/4885KLK5 2545/4885CA1 1113/4885
US-20100256092-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BCL6, BTD KLK1 1578/4885KLK5 1864/4885CA1 4452/4885
US-11807726-B2 Method of crosslinking glycosaminoglycans CD44, HPSE, CSGALNACT1 KLK1 1271/4885KLK5 2545/4885CA1 1113/4885
US-20110207702-A1 BORON-CONTAINING SMALL MOLECULES AS ANTI-PROTOZOAL AGENTS BRDT, BRI3BP, BTN3A1 KLK1 3925/4885KLK5 4343/4885CA1 1800/4885

“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.