SCHEMBL564786

SCHEMBL564786

OB1OCc2cc(O)ccc21

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.65
CA2 P00918 5/20 0.65
PDE3A Q14432 2/20 0.65
PDE4B Q07343 12/20 0.57
PDE4A P27815 10/20 0.57
PDE4C Q08493 10/20 0.57
PDE4D Q08499 10/20 0.57
CA12 O43570 3/20 0.50
CA9 Q16790 3/20 0.50
CHRM1 P11229 1/20 0.49
ADRA1A P35348 1/20 0.49
PDE1A P54750 1/20 0.49
PDE3B Q13370 1/20 0.49
PDE7A Q13946 1/20 0.49
CA4 P22748 1/20 0.46
KLK5 Q9Y337 1/20 0.45

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
SCHEMBL1135328 0.84 CA1 (0.65) CA1CA2CA12CA9CA4
An-2718 SCHEMBL5583381 0.82 PDE4B (0.69) CA1CA2PDE3APDE4BPDE4A
An-2718 SCHEMBL500874 0.82 PDE4B (0.69) CA1CA2PDE3APDE4BPDE4A
SCHEMBL564776 0.81 CA1 (0.43) CA1CA2PDE3APDE4BPDE4A
SCHEMBL10268396 0.78 CA1 (0.62) CA1CA2PDE3APDE4BPDE4A
SCHEMBL499992 0.78 PDE4B (0.69) CA1CA2PDE3APDE4BPDE4A
SCHEMBL5583348 0.78 PDE4B (0.69) CA1CA2PDE3APDE4BPDE4A
Tavaborole SCHEMBL500016 0.78 CA1 (1.00) CA1CA2PDE3APDE4BPDE4A
SCHEMBL10220172 0.78 CA1 (0.62) CA1CA2PDE3APDE4BPDE4A
SCHEMBL14473060 0.78 CA1 (0.62) CA1CA2PDE3APDE4BPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115260218-A Preparation method of clilboro 安庆百谊生物科技有限公司 2022-11-01 CN disclosed
EP-3971191-A1 BORON-CONTAINING SMALL MOLECULES Bill And Melinda Gates Foundation (US) 2022-03-23 EP disclosed
WO-2022035997-A1 IN VIVO ASSEMBLY OF ASGPR BINDING THERAPEUTICS AVILAR THERAPEUTICS, INC. (US) 2022-02-17 WO disclosed
US-11091504-B2 Process for the preparation of tavaborole, its novel polymorphic forms and the polymorphs thereof BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2021-08-17 US disclosed
EP-3423065-B1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS INC (US) 2021-07-21 EP disclosed
US-10919916-B2 Boron-containing small molecules BILL & MELINDA GATES FOUNDATION (US) 2021-02-16 US disclosed
US-20200247827-A1 BORON-CONTAINING SMALL MOLECULES BILL & MELINDA GATES FOUNDATION (US) 2020-08-06 US disclosed
US-10611780-B2 Boron-containing small molecules BILL AND MELINDA GATES FOUNDATION (US) 2020-04-07 US disclosed
US-20200087325-A1 Novel Process for the Preparation of Tavaborole, Its Novel Polymorphic Forms and the Polymorphs Thereof BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2020-03-19 US disclosed
US-10435419-B2 Process for the preparation of tavaborole, its novel polymorphic forms and the polymorphs thereof BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2019-10-08 US disclosed
US-8039450-B2 Boron-containing small molecules as anti-inflammatory agents ANACOR PHARMACEUTICALS, INC. (US) 2011-10-18 US disclosed
US-8039450-B2 Boron-containing small molecules as anti-inflammatory agents ANACOR PHARMACEUTICALS, INC. (US) 2011-10-18 US disclosed
WO-2011094450-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC (US) 2011-08-04 WO disclosed
WO-2011094450-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC (US) 2011-08-04 WO disclosed
EP-2187893-A2 BORON-CONTAINING SMALL MOLECULES AS ANTI-INFLAMMATORY AGENTS Anacor Pharmaceuticals, Inc. (US) 2010-05-26 EP disclosed
US-20090291917-A1 Boron-Containing Small Molecules as Anti-Inflammatory Agents ANACOR PHARMACEUTICALS, INC. (US) 2009-11-26 US disclosed
US-20090291917-A1 Boron-Containing Small Molecules as Anti-Inflammatory Agents ANACOR PHARMACEUTICALS, INC. (US) 2009-11-26 US disclosed
US-20090291917-A1 Boron-Containing Small Molecules as Anti-Inflammatory Agents ANACOR PHARMACEUTICALS, INC. (US) 2009-11-26 US disclosed
WO-2009111676-A2 BORON-CONTAINING SMALL MOLECULES AS ANTI-INFLAMMATORY AGENTS ANACOR PHARMACEUTICALS, INC (US) 2009-09-11 WO disclosed
WO-2009111676-A2 BORON-CONTAINING SMALL MOLECULES AS ANTI-INFLAMMATORY AGENTS ANACOR PHARMACEUTICALS, INC (US) 2009-09-11 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 (7 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-20200087325-A1 Novel Process for the Preparation of Tavaborole, Its Novel Polymorphic Forms and the Polymorphs Thereof VKORC1L1, VPS4B, HLA-B CA1 4520/4885CA2 4453/4885PDE3A 3861/4885
US-11091504-B2 Process for the preparation of tavaborole, its novel polymorphic forms and the polymorphs thereof HLA-B, VKORC1L1, VPS4B CA1 4579/4885CA2 4423/4885PDE3A 3861/4885
US-20090291917-A1 Boron-Containing Small Molecules as Anti-Inflammatory Agents NFKBIA, LITAF, CD68 CA1 1538/4885CA2 829/4885PDE3A 1691/4885
US-10919916-B2 Boron-containing small molecules BCL6B, BLVRB, BTD CA1 3591/4885CA2 743/4885PDE3A 1953/4885
US-10611780-B2 Boron-containing small molecules BCL6B, BLVRB, BTD CA1 3591/4885CA2 743/4885PDE3A 1953/4885
US-20200247827-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BLVRB, BTD CA1 3591/4885CA2 743/4885PDE3A 1953/4885
US-10435419-B2 Process for the preparation of tavaborole, its novel polymorphic forms and the polymorphs thereof HLA-B, VKORC1L1, VPS4B CA1 4579/4885CA2 4423/4885PDE3A 3861/4885

“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.