SCHEMBL2360716

SCHEMBL2360716

Nc1nc2cc(C(F)(F)F)ccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MASP2 O00187 1/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ NUDT1 P36639 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ AOC3 Q16853 1/20 0.48
▸ BACE1 P56817 2/20 0.46
▸ FABP6 P51161 1/20 0.46
▸ KIF11 P52732 4/20 0.45
▸ EPHX2 P34913 1/20 0.44
▸ SCN4A P35499 1/20 0.44
▸ PLAU P00749 1/20 0.43
▸ HTR3E A5X5Y0 1/20 0.43
▸ HTR3B O95264 1/20 0.43
▸ HTR3A P46098 1/20 0.43
▸ HTR3D Q70Z44 1/20 0.43
▸ HTR3C Q8WXA8 1/20 0.43
▸ XDH P47989 1/20 0.43
▸ NPBWR1 P48145 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.42

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
SCHEMBL30218684 1.00 MASP2 (0.48) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL28811431 0.88 ALDH1A1 (0.47) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL30672494 0.86 NPBWR1 (0.58) BACE1PLAUHTR3EHTR3BHTR3A
SCHEMBL3589452 0.86 NPBWR1 (0.58) BACE1PLAUHTR3EHTR3BHTR3A
SCHEMBL119520 0.83 XDH (0.56) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL13619366 0.82 FABP6 (0.50) MASP2MEN1ALDH1A1NUDT1KMT2A
Bromide SCHEMBL2381467 0.82 XDH (0.54) MASP2MEN1ALDH1A1NUDT1KMT2A
Bromide SCHEMBL117671 0.82 XDH (0.54) MASP2MEN1ALDH1A1NUDT1KMT2A
SCHEMBL5681855 0.80 NPSR1 (0.59) ALDH1A1KIF11NPBWR1KDM4EMETAP2
SCHEMBL666767 0.79 NPBWR1 (0.43) KIF11NPBWR1KDM4EMETAP2DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4351578-A1 SMALL MOLECULAR INHIBITORS OF STING SIGNALING COMPOSITIONS AND METHODS OF USE Stinginn Inc (US) 2024-04-17 — — EP disclosed
CN-117126578-A Organosilicon polymer/POSS hybrid antifouling coating grafted with antibacterial molecules and preparation method thereof 中国科学院海洋研究所 2023-11-28 — — CN disclosed
WO-2022245986-A1 SMALL MOLECULAR INHIBITORS OF STING SIGNALING COMPOSITIONS AND METHODS OF USE STINGINN INC (US) 2022-11-24 — — WO disclosed
US-10005769-B2 2,3-dihydrobenzofuran-5YL compounds as DYRK kinase inhibitors 4SC AG (DE) 2018-06-26 — — US disclosed
US-20160137637-A1 2,3-DIHYDROBENZOFURAN-5YL COMPOUNDS AS DYRK KINASE INHIBITORS 4SC DISCOVERY GMBH (DE) 2016-05-19 — — US disclosed
EP-1653951-B1 BENZIMIDAZOLE DERIVATIVES AS RAF KINASE INHIBITORS MERCK PATENT GMBH (DE) 2011-12-28 — — EP disclosed
EP-1653951-B1 BENZIMIDAZOLE DERIVATIVES AS RAF KINASE INHIBITORS MERCK PATENT GMBH (DE) 2011-12-28 — — EP disclosed
WO-2011099832-A2 NOVEL BENZIMIDAZOLE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME CRYSTALGENOMICS, INC. (KR) 2011-08-18 — — WO disclosed
US-7691886-B2 Benzimidazole derivatives as raf kinase inhibitors MERCK PATENT GMBH (DE) 2010-04-06 — — US disclosed
US-7691886-B2 Benzimidazole derivatives as raf kinase inhibitors MERCK PATENT GMBH (DE) 2010-04-06 — — US disclosed
US-20070010560-A1 angiogenesis, in particular in tumors, restenoses, diabetic retinopathy, macular degenerative disease or rheumatoid arthritis MERCK PATENT GMBH (DE) 2007-01-11 — — US disclosed
US-20070010560-A1 angiogenesis, in particular in tumors, restenoses, diabetic retinopathy, macular degenerative disease or rheumatoid arthritis MERCK PATENT GMBH (DE) 2007-01-11 — — US disclosed
US-20070010560-A1 angiogenesis, in particular in tumors, restenoses, diabetic retinopathy, macular degenerative disease or rheumatoid arthritis MERCK PATENT GMBH (DE) 2007-01-11 — — US disclosed
EP-1620413-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2006-02-01 — — EP disclosed
WO-2004098494-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2004-11-18 — — WO disclosed
US-4316021-A VIRICIDES ELI LILLY AND COMPANY (US) 1982-02-16 — — US disclosed
US-4243813-A VIRICIDES ELI LILLY AND COMPANY (US) 1981-01-06 — — US disclosed
US-4196125-A VIRICIDES ELI LILLY AND COMPANY (US) 1980-04-01 — — US disclosed
US-4118573-A ANTIVIRAL AGENTS ELI LILLY AND COMPANY (US) 1978-10-03 — — US disclosed
US-4018790-A VIRICIDES ELI LILLY AND COMPANY (US) 1977-04-19 — — 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 (3 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-20070010560-A1 angiogenesis, in particular in tumors, restenoses, diabetic retinopathy, macular degenerative disease or rheumatoid arthritis BRAF, RAF1, VEGFA MASP2 2940/4885MEN1 2167/4885ALDH1A1 565/4885
US-10005769-B2 2,3-dihydrobenzofuran-5YL compounds as DYRK kinase inhibitors DYRK2, DYRK1B, DYRK1A MASP2 2584/4885MEN1 3869/4885ALDH1A1 2116/4885
US-20160137637-A1 2,3-DIHYDROBENZOFURAN-5YL COMPOUNDS AS DYRK KINASE INHIBITORS DYRK2, DYRK1B, DYRK1A MASP2 2584/4885MEN1 3869/4885ALDH1A1 2116/4885

“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.

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