SCHEMBL1852238

SCHEMBL1852238

Cc1cc(Br)cc(C#N)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.39
ALB P02768 2/20 0.39
GABRA1 P14867 2/20 0.39
GABRB1 P18505 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 2/20 0.36
CYP3A4 P08684 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
EGFR P00533 2/20 0.34
ERBB2 P04626 1/20 0.34
GPR35 Q9HC97 2/20 0.33
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
UPP1 Q16831 1/20 0.32
ESR1 P03372 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
SCHEMBL31287357 1.00 TTR (0.39) TTRALBGABRA1GABRB1MEN1
SCHEMBL1423613 0.78 CYP3A4 (0.56) TTRALBGABRA1GABRB1MEN1
SCHEMBL25768539 0.78 TSHR (0.38) MEN1KMT2ATSHRGPR35MAOA
SCHEMBL4711658 0.78 ALDH1A1 (0.46) TTRALBKMT2ATSHRTDP1
SCHEMBL49544 0.77 CA1 (0.58) TTRGABRA1GABRB1MEN1KMT2A
SCHEMBL14321234 0.75 TSHR (0.35) TSHRGPR35MAOAMAOB
SCHEMBL2656947 0.75 TSHR (0.36) TSHRCYP3A4TDP1GPR35MAOA
SCHEMBL20777579 0.75 KDM4E (0.40) TTRALBTSHRCA1CA2
SCHEMBL30633345 0.75 TSHR (0.35) TSHRGPR35MAOAMAOB
SCHEMBL19779546 0.75 PTGS1 (0.42) TTRALBTSHRCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114025847-B Compounds and compositions as modulators of TLR signaling 神经孔疗法股份有限公司 2024-05-24 CN disclosed
US-11591342-B2 Heterocyclic compound, application thereof and pharmaceutical composition comprising same Suzhou Sinovent Pharmaceuticals Co., Ltd. (CN) 2023-02-28 US disclosed
US-20220298155-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2022-09-22 US disclosed
US-11299487-B2 Compounds and compositions as modulators of TLR signaling NEUROPORE THERAPIES, INC. (US) 2022-04-12 US disclosed
EP-3946599-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING Neuropore Therapies, Inc. (US) 2022-02-09 EP disclosed
CN-114025847-A Compounds and compositions as modulators of TLR signaling 神经孔疗法股份有限公司 2022-02-08 CN disclosed
CN-111620865-B Heterocyclic compound, application thereof and pharmaceutical composition containing same 苏州信诺维医药科技股份有限公司 2021-06-11 CN disclosed
EP-3517536-B1 AMINOTRIAZINE DERIVATIVES USEFUL AS TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES INC (US) 2021-05-05 EP disclosed
EP-3753943-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Suzhou Sinovent Pharmaceuticals Co., Ltd. (CN) 2020-12-23 EP disclosed
EP-3753943-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Suzhou Sinovent Pharmaceuticals Co., Ltd. (CN) 2020-12-23 EP disclosed
WO-2016049211-A1 AMINOTRIAZINE DERIVATIVES USEFUL AS TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. (US) 2016-03-31 WO disclosed
EP-2097419-B1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS INC (US) 2011-05-25 EP disclosed
EP-2097419-B1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS INC (US) 2011-05-25 EP disclosed
CN-101965351-A Benzofuran pyrimidinones EXELIXIS INC 2011-02-02 CN disclosed
US-20090247559-A1 Benzofuropyrimidinones EXELIXIS, INC. (US) 2009-10-01 US disclosed
US-20090247559-A1 Benzofuropyrimidinones EXELIXIS, INC. (US) 2009-10-01 US disclosed
US-20090247559-A1 Benzofuropyrimidinones EXELIXIS, INC. (US) 2009-10-01 US disclosed
EP-2097419-A1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS Exelixis, Inc. (US) 2009-09-09 EP disclosed
WO-2009086264-A1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS, INC. (US) 2009-07-09 WO disclosed
WO-2009086264-A1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS, INC. (US) 2009-07-09 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-11591342-B2 Heterocyclic compound, application thereof and pharmaceutical composition comprising same ENPP2, ATXN10, PCSK9 TTR 1310/4885ALB 1839/4885GABRA1 3775/4885
US-20220298155-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING TLR3, TLR6, TLR4 TTR 1395/4885ALB 2862/4885GABRA1 2639/4885
US-20090247559-A1 Benzofuropyrimidinones F12, BRI3BP, BRD1 TTR 3424/4885ALB 3342/4885GABRA1 113/4885
US-11299487-B2 Compounds and compositions as modulators of TLR signaling TLR3, TLR6, TLR4 TTR 1472/4885ALB 2876/4885GABRA1 2008/4885

“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.