SCHEMBL2330243

SCHEMBL2330243

O=C(O)c1cn(-c2ccc(F)cc2)nn1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.57
CA2 P00918 4/20 0.57
CA9 Q16790 3/20 0.57
CA4 P22748 2/20 0.57
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ESRRA P11474 2/20 0.47
KMT2A Q03164 1/20 0.46
MIF P14174 1/20 0.46
NOTUM Q6P988 1/20 0.46
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
FLT3 P36888 1/20 0.45
PTGS2 P35354 2/20 0.44
CA5A P35218 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
PTGS1 P23219 1/20 0.44
CA12 O43570 1/20 0.43

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
SCHEMBL27911606 0.98 CA1 (0.56) CA1CA2CA9CA4NPC1
SCHEMBL30398809 0.85 CA1 (0.59) CA1CA2CA9CA4NPC1
SCHEMBL14701729 0.85 CA1 (0.56) CA1CA2CA9CA4NPC1
SCHEMBL28033864 0.85 CA1 (0.56) CA1CA2CA9CA4NPC1
SCHEMBL27877288 0.84 ESRRA (0.57) CA1CA2CA9CA4ESRRA
SCHEMBL69876 0.84 ESRRA (0.62) CA1CA2CA9CA4NPC1
SCHEMBL3477570 0.83 CA1 (0.57) CA1CA2CA9CA4ESRRA
SCHEMBL11902351 0.83 CA1 (0.57) CA1CA2CA9CA4NPC1
SCHEMBL71817 0.83 NOTUM (0.43) CA1CA2CA9CA4NPC1
SCHEMBL28801446 0.82 ESRRA (0.60) CA1CA2CA9CA4NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12398147-B2 Macrocyclic spiropyrrolidine derived antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2025-08-26 US disclosed
US-11691992-B2 Oxaborole analogs and uses thereof ANACOR PHARMACEUTICALS, INC. (US) 2023-07-04 US disclosed
US-20220402926-A1 NOVEL MACROCYCLIC SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2022-12-22 US disclosed
US-20220402926-A1 NOVEL MACROCYCLIC SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2022-12-22 US disclosed
WO-2022240541-A1 NOVEL MACROCYCLIC SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2022-11-17 WO disclosed
US-11319325-B1 Macrocyclic spiropyrrolidine derived antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2022-05-03 US disclosed
US-20210253605-A1 NOVEL OXABOROLE ANALOGS AND USES THEREOF ANACOR PHARMACEUTICALS INC (US) 2021-08-19 US disclosed
US-10961261-B2 Oxaborole analogs and uses thereof ANACOR PHARMACEUTICALS, INC. (US) 2021-03-30 US disclosed
EP-3609504-A1 NOVEL OXABOROLE ANALOGS AND USES THEREOF Anacor Pharmaceuticals, Inc. (US) 2020-02-19 EP disclosed
WO-2018160845-A1 NOVEL OXABOROLE ANALOGS AND USES THEREOF ANACOR PHARMACEUTICALS, INC. (US) 2018-09-07 WO disclosed
US-20150191458-A1 TRIAZOLE CARBOXAMIDES AND USES THEREOF HOFFMANN-LA ROCHE INC. (US) 2015-07-09 US disclosed
CN-104603129-A Triazole carboxamide derivatives HOFFMANN LA ROCHE 2015-05-06 CN disclosed
WO-2014041106-A1 TRIAZOLE CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2014-03-20 WO disclosed
US-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS PHARMASCIENCE INC. (CA) 2013-02-14 US disclosed
EP-2534170-A1 IAP BIR DOMAIN BINDING COMPOUNDS Pharmascience Inc. (CA) 2012-12-19 EP disclosed
US-20120202794-A1 COMPOUNDS PHARMASSET, INC. (US) 2012-08-09 US disclosed
WO-2011098904-A1 IAP BIR DOMAIN BINDING COMPOUNDS AEGERA THERAPEUTICS, INC. (CA) 2011-08-18 WO disclosed
US-20080200519-A1 TETRAHYDRONAPHTHALENYLAMIDES, A PROCESS FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS BAYER SCHERING PHARMA AG (DE) 2008-08-21 US disclosed
WO-2008098798-A1 TETRAHYDRONAPHTHALENYLAMIDES, A PROCESS FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-08-21 WO disclosed
EP-1958934-A1 Tetrahydronaphthalenylamides, a process for their production and their use as anti-inflammatory agents Bayer Schering Pharma Aktiengesellschaft (DE) 2008-08-20 EP 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-20150191458-A1 TRIAZOLE CARBOXAMIDES AND USES THEREOF TAAR1, HCRTR1, TAAR5 CA1 2431/4885CA2 1361/4885CA9 3263/4885
US-11691992-B2 Oxaborole analogs and uses thereof OXA1L, EPX, OAT CA1 1411/4885CA2 914/4885CA9 2004/4885
US-20120202794-A1 COMPOUNDS HAVCR2, MAVS, GOT2 CA1 4880/4885CA2 4824/4885CA9 4366/4885
US-20220402926-A1 NOVEL MACROCYCLIC SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ACE, ACE2, PKD1 CA1 4161/4885CA2 2080/4885CA9 2168/4885
US-12398147-B2 Macrocyclic spiropyrrolidine derived antiviral agents ACE, ACE2, PKD1 CA1 3740/4885CA2 1745/4885CA9 1594/4885
US-20210253605-A1 NOVEL OXABOROLE ANALOGS AND USES THEREOF OXA1L, AOX1, EPX CA1 2840/4885CA2 1841/4885CA9 3215/4885
US-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS BIRC5, BIRC2, BIRC3 CA1 3367/4885CA2 3311/4885CA9 2677/4885
US-10961261-B2 Oxaborole analogs and uses thereof OXA1L, EPX, OAT CA1 1411/4885CA2 914/4885CA9 2004/4885
US-11319325-B1 Macrocyclic spiropyrrolidine derived antiviral agents ACE, ACE2, PKD1 CA1 3740/4885CA2 1745/4885CA9 1594/4885
US-20080200519-A1 TETRAHYDRONAPHTHALENYLAMIDES, A PROCESS FOR THEIR PRODUCTION AND THEIR USE AS ANTI-INFLAMMATORY AGENTS PTGES, PTGS1, PTGS2 CA1 4137/4885CA2 2819/4885CA9 3532/4885

“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.