SCHEMBL8076402

SCHEMBL8076402

Cc1ccc2c(c1)B(O)OC2

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA1 P00915 9/20 0.62
CA2 P00918 9/20 0.62
CA9 Q16790 7/20 0.62
CA12 O43570 6/20 0.62
CA4 P22748 3/20 0.57
PDE4A P27815 1/20 0.55
PDE4B Q07343 1/20 0.55
PDE4C Q08493 1/20 0.55
PDE4D Q08499 1/20 0.55
CA7 P43166 1/20 0.53

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
SCHEMBL5583348 0.85 PDE4B (0.69) CA1CA2CA9CA12CA4
SCHEMBL499992 0.85 PDE4B (0.69) CA1CA2CA9CA12CA4
SCHEMBL596577 0.82 CA1 (0.56) CA1CA2CA9CA12CA4
SCHEMBL13470651 0.82 PDE4A (0.78) PDE4APDE4BPDE4CPDE4D
SCHEMBL19851265 0.81 CA1 (0.58) CA1CA2CA9CA12CA4
SCHEMBL13470643 0.80 CA1 (0.53) CA1CA2CA9CA12CA4
SCHEMBL20936503 0.79 CA1 (0.46) CA1CA2CA9CA12CA4
SCHEMBL12521418 0.78 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL1135328 0.78 CA1 (0.65) CA1CA2CA9CA12CA4
SCHEMBL12875294 0.77 CA1 (0.78) CA1CA2CA9CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230226057-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT, AMELIORATION OR PREVENTION OF FIBROTIC DISEASE TOLREMO THERAPEUTICS AG (CH) 2023-07-20 US disclosed
US-20230137869-A1 METHOD OF SUGAR-GUIDED MODIFYING GLYCOSYLATED POLYPEPTIDE AND APPLICATION OF THE SAME NATIONAL SUN YAT-SEN UNIVERSITY (TW) 2023-05-04 US disclosed
US-20230137869-A1 METHOD OF SUGAR-GUIDED MODIFYING GLYCOSYLATED POLYPEPTIDE AND APPLICATION OF THE SAME NATIONAL SUN YAT-SEN UNIVERSITY (TW) 2023-05-04 US disclosed
EP-3842420-B1 HETEROARYL INHIBITORS OF PDE4 TETRA DISCOVERY PARTNERS LLC (US) 2022-12-07 EP disclosed
EP-3842420-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners LLC (US) 2021-06-30 EP disclosed
WO-2021108683-A1 COVALENT RAS INHIBITORS AND USES THEREOF Revolution Medicines, Inc. (US) 2021-06-03 WO disclosed
WO-2021064142-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT OR AMELIORATION OF CANCER TOLREMO THERAPEUTICS AG (CH) 2021-04-08 WO disclosed
US-10874679-B2 Boron-containing small molecules BILL & MELINDA GATES FOUNDATION (US) 2020-12-29 US disclosed
US-20200230160-A1 BORON-CONTAINING SMALL MOLECULES BILL AND MELINDA GATES FOUNDATION (US) 2020-07-23 US disclosed
WO-2020114499-A1 TYROSINE KINASE INHIBITORS, COMPOSITIONS AND METHODS THERE OF BETTA PHARMACEUTICALS CO., LTD (CN) 2020-06-11 WO disclosed
EP-2343304-A1 Biocidal boronophthalide compounds Anacor Pharmaceuticals, Inc. (US) 2011-07-13 EP disclosed
US-20100267981-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2010-10-21 US disclosed
US-7767657-B2 Boron-containing small molecules ANACOR PHARMACEUTICALS, INC. (US) 2010-08-03 US disclosed
US-20070155699-A1 Boron-containing small molecules ANACOR PHARMACEUTICALS (US) 2007-07-05 US disclosed
CN-1068005-C Oxaboroles and salts thereof, and thire use as biocides ZENECA LTD (GB) 2001-07-04 CN disclosed
EP-0765331-B1 OXABOROLES AND SALTS THEREOF, AND THEIR USE AS BIOCIDES AVECIA LTD (GB) 2000-08-09 EP disclosed
US-5880188-A PROTECTING MEDIUM SUSCEPTIBLE TO MICROBIAL ATTACK BY TREATING WITH SPECIFIED OXABOROLE COMPOUND ZENECA LIMITED (GB) 1999-03-09 US disclosed
CN-1155286-A Oxaboroles and salts thereof, and thire use as biocides ZENECA LTD (GB) 1997-07-23 CN disclosed
EP-0765331-A1 OXABOROLES AND SALTS THEREOF, AND THEIR USE AS BIOCIDES ZENECA LIMITED (GB) 1997-04-02 EP disclosed
WO-1995033754-A1 OXABOROLES AND SALTS THEREOF, AND THEIR USE AS BIOCIDES ZENECA LIMITED (GB) 1995-12-14 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 (6 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-20200230160-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BLVRB, BTD CA1 3591/4885CA2 743/4885CA9 380/4885
US-10874679-B2 Boron-containing small molecules BCL6B, BLVRB, BTD CA1 3591/4885CA2 743/4885CA9 380/4885
US-20070155699-A1 Boron-containing small molecules ETF1, POLR1C, DPM1 CA1 4091/4885CA2 1368/4885CA9 980/4885
US-20100267981-A1 BORON-CONTAINING SMALL MOLECULES ETF1, POLR1C, DPM1 CA1 4091/4885CA2 1368/4885CA9 980/4885
US-20230226057-A1 HETEROCYCLIC DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE IN THE TREATMENT, AMELIORATION OR PREVENTION OF FIBROTIC DISEASE CPT1A, SLC10A1, FGF1 CA1 2894/4885CA2 1442/4885CA9 1616/4885
US-20230137869-A1 METHOD OF SUGAR-GUIDED MODIFYING GLYCOSYLATED POLYPEPTIDE AND APPLICATION OF THE SAME DNPEP, FUT6, MGAM CA1 1039/4885CA2 1792/4885CA9 306/4885

“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.