Sugi Predict

Sugi Predict / Compounds / SCHEMBL6505461

SCHEMBL6505461

SCHEMBL6505461

c1ccc(-c2ccc(-c3nnn[nH]3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 4/20 0.41
▸ NR1H3 Q13133 4/20 0.41
▸ BTK Q06187 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ DCUN1D1 Q96GG9 3/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ DGAT1 O75907 1/20 0.38
▸ MTOR P42345 1/20 0.38
▸ ADK P55263 1/20 0.38
▸ NISCH Q9Y2I1 1/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ NPY5R Q15761 1/20 0.36
▸ SCN2A Q99250 1/20 0.36
▸ FGFR1 P11362 1/20 0.36

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
Bromide SCHEMBL27863912 0.98 NR1H2 (0.39) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL4950 0.96 NR1H2 (0.43) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL28994299 0.93 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL3962514 0.93 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL2954445 0.93 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
Selenium SCHEMBL30289776 0.93 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
Water SCHEMBL7382263 0.93 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
Bromide SCHEMBL8589844 0.93 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL22498864 0.93 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E
SCHEMBL10635278 0.93 NR1H2 (0.42) NR1H2NR1H3BTKALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116925378-A CuIn-MOF metal organic framework material, preparation method thereof and application thereof in adsorbing carbon dioxide 吉林大学 2023-10-24 — — CN disclosed
CN-116925378-A CuIn-MOF metal organic framework material, preparation method thereof and application thereof in adsorbing carbon dioxide 吉林大学 2023-10-24 — — CN disclosed
WO-2023275422-A1 COMPOUND COMPRISING RUTHENIUM(III) AND 2,2'-BIIMIDAZOLE (RUNAT-BI) AND THE THERAPEUTIC USE THEREOF UNIVERSITAT DE VALÈNCIA (ES) 2023-01-05 — — WO disclosed
CN-102341402-A Thienopyridines as pharmacologically active agents COUNCIL SCIENT IND RES 2012-02-01 — — CN disclosed
US-7906038-B2 Aqueous polishing liquid and chemical mechanical polishing method FUJIFILM CORPORATION (JP) 2011-03-15 — — US disclosed
US-7906038-B2 Aqueous polishing liquid and chemical mechanical polishing method FUJIFILM CORPORATION (JP) 2011-03-15 — — US disclosed
US-7857985-B2 Metal-polishing liquid and chemical mechanical polishing method using the same FUJIFILM CORPORATION (JP) 2010-12-28 — — US disclosed
US-7857985-B2 Metal-polishing liquid and chemical mechanical polishing method using the same FUJIFILM CORPORATION (JP) 2010-12-28 — — US disclosed
EP-2168576-A2 New utilities of tricyclic compounds Shionogi & Co., Ltd. (JP) 2010-03-31 — — EP disclosed
US-7547335-B2 Metal polishing composition and method of polishing using the same FUJIFILM CORPORATION (JP) 2009-06-16 — — US disclosed
US-20070186484-A1 Metal-polishing liquid and chemical mechanical polishing method using the same FUJIFILM CORPORATION (JP) 2007-08-16 — — US disclosed
US-20070186484-A1 Metal-polishing liquid and chemical mechanical polishing method using the same FUJIFILM CORPORATION (JP) 2007-08-16 — — US disclosed
US-20070069176-A1 Aqueous polishing liquid and chemical mechanical polishing method FUJI PHOTO FILM CO., LTD. 2007-03-29 — — US disclosed
US-20070069176-A1 Aqueous polishing liquid and chemical mechanical polishing method FUJI PHOTO FILM CO., LTD. 2007-03-29 — — US disclosed
US-6855725-B2 Excitatory amino acid receptor antagonists ELI LILLY AND COMPANY (US) 2005-02-15 — — US disclosed
US-20040063749-A1 Excitatory amino acid receptor antagonists BLEISCH THOMAS JOHN (US) 2004-04-01 — — US disclosed
EP-1351952-A2 PYRROLIDINYLMETHYL SUBSTITUTED DECAHYDROISOQUINOLINES AS EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2003-10-15 — — EP disclosed
WO-2002053556-A2 PYRROLIDINYLMETHYL SUBSTITUTED DECAHYDROISOQUINOLINES AS EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2002-07-11 — — WO disclosed
US-5932362-A SPECIFIC OXADIAZOLE COMPOUND BETWEEN AN ANODE AND CATHODE; ELECTROLUMINESCENT DEVICE HAVING HIGH DURABILITY AND ELECTRON-TRASPORTING PROPERTIES RICOH COMPANY, LTD. (JP) 1999-08-03 — — US disclosed
US-5702833-A DURABILITY RICOH COMPANY, LTD. (JP) 1997-12-30 — — 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 (1 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-20040063749-A1 Excitatory amino acid receptor antagonists SLC1A2, SLC1A1, SLC1A3 NR1H2 890/4885NR1H3 1174/4885BTK 4221/4885

“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.