SCHEMBL1809895

SCHEMBL1809895

C(#Cc1ccccn1)c1ccccc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.58
▸ GRM5 P41594 5/20 0.55
▸ APP P05067 1/20 0.55
▸ GRM4 Q14833 1/20 0.53
▸ KCNH2 Q12809 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ PKM P14618 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ THPO P40225 1/20 0.52
▸ RAB9A P51151 1/20 0.52

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
SCHEMBL30214468 1.00 FFAR1 (0.58) FFAR1GRM5APPGRM4KCNH2
Hydrochloric Acid SCHEMBL19668206 0.98 FFAR1 (0.57) FFAR1GRM5APPGRM4KCNH2
SCHEMBL27965841 0.90 FFAR1 (0.55) FFAR1GRM5GRM4KCNH2
SCHEMBL352291 0.88 GRM5 (0.65) GRM5KCNH2CYP1A2
SCHEMBL31673060 0.87 GRM5 (0.55) FFAR1GRM5KCNH2CYP1A2
SCHEMBL7873393 0.84 FFAR1 (0.49) FFAR1GRM5KCNH2CYP1A2
SCHEMBL14061855 0.84 GRM5 (0.53) FFAR1GRM5KCNH2
SCHEMBL5569770 0.84 GRM5 (0.53) FFAR1GRM5KCNH2CYP1A2
SCHEMBL28950042 0.84 GRM5 (0.56) FFAR1GRM5KCNH2
SCHEMBL4750207 0.84 FFAR1 (0.53) FFAR1GRM5KCNH2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108794385-B Method for synthesizing phenylethynyl pyridine derivative 陕西师范大学 2021-09-21 — — CN claimed
CN-108794385-A A method of synthesis phenylethynylpyridin derivative 陕西师范大学 2018-11-13 — — CN claimed
EP-1294699-B1 MODULATORS OF TNF- ALPHA SIGNALLING GENZYME CORP (US) 2016-04-13 — — EP claimed
US-7432403-B2 Cyclic palladium compounds having coordinated thereto bis (diphenylphosphine) ferrocene ligands which inhibit the activity of proteins and enzymes and treatment of diseases and disorders associated therewith Fundação De Amparo À Pesquisa Do Estado de São Paulo (BR) 2008-10-07 — — US claimed
US-20060106100-A1 Cyclic palladium compounds having coordinated thereto bis (diphenylphosphine) ferrocene ligands which inhibit the activity of proteins and enzymes and treatment of diseases and disorders associated therewith FUNDACAO DE AMPARO A PESQUISA DO ESTADO DE SAO PAULO (BR) 2006-05-18 — — US claimed
CN-120463640-A Method for preparing diaryl acetylene and phenylethynyl pyridine photocycloaddition product 北京化工大学 2025-08-12 — — CN disclosed
CN-120463640-A Method for preparing diaryl acetylene and phenylethynyl pyridine photocycloaddition product 北京化工大学 2025-08-12 — — CN disclosed
CN-118290328-A Hydrocarbon pyridine and preparation method thereof 北京师范大学 2024-07-05 — — CN disclosed
US-11993618-B2 Water soluble mono-branched and di-branched complexing agents, and corresponding lanthanide complexes CISBIO BIOASSAYS (FR) 2024-05-28 — — US disclosed
EP-4366739-A1 PHOSPHODIESTERASE INHIBITORS FOR THE MITIGATION OF FRAGILE X SYNDROME SYMPTOMS The Royal Institution for the Advancement of Learning / McGill University (CA) 2024-05-15 — — EP disclosed
EP-2945957-B1 NOVEL WATER-SOLUBLE COMPLEXING AGENTS AND CORRESPONDING LANTHANIDE COMPLEXES CISBIO BIOASSAYS (FR) 2023-11-08 — — EP disclosed
CN-110914259-B Novel water-soluble mono-and di-branched complexing agents and corresponding lanthanide complexes CISBIO生物试验公司 2023-10-20 — — CN disclosed
WO-2005104836-A2 DROSOPHILA MODELS FOR DISEASES AFFECTING LEARNING AND MEMORY ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2005-11-10 — — WO disclosed
WO-2005056719-A1 ORGANIC ELEMENT FOR ELECTROLUMINESCENT DEVICES EASTMAN KODAK COMPANY (US) 2005-06-23 — — WO disclosed
US-20050123795-A1 Having a phosphorescent light emitting layer containing an organometallic complex with Iridium, Rhodium, Osmium, Platinumt, or Palladium and a fused pyrazole or imidazole compound GLOBAL OLED TECHNOLOGY LLC 2005-06-09 — — US disclosed
US-6686345-B2 INCLUDES AN AZA-ENEDIYNE, AZA-ENYNE ALLENE, OR AN AZA-DIALLENE; ARE PREFERABLY NON-HYDROLYZABLE, CATIONIC COMPOUNDS THAT BIND TO NUCLEIC ACIDS. RESEARCH DEVELOPMENT FOUNDATION 2004-02-03 — — US disclosed
US-20020132797-A1 DNA-cleaving antitumor agents NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-09-19 — — US disclosed
US-5886240-A Process for preparing aromatic acetylenes using palladacycles as catalysts HOECHST AKTIENGESELLSCHAFT (DE) 1999-03-23 — — US disclosed
US-5457186-A Immunoassay WALLAC OY (FI) 1995-10-10 — — US disclosed
EP-0649020-A1 Luminescent lanthanide chelates with decreased non-radiative energy loss WALLAC OY (FI) 1995-04-19 — — 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 (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-11993618-B2 Water soluble mono-branched and di-branched complexing agents, and corresponding lanthanide complexes LASP1, RCC1, LGALS1 FFAR1 2635/4885GRM5 4165/4885APP 4206/4885
US-20060106100-A1 Cyclic palladium compounds having coordinated thereto bis (diphenylphosphine) ferrocene ligands which inhibit the activity of proteins and enzymes and treatment of diseases and disorders associated therewith PREP, DNPEP, RNASE1 FFAR1 4769/4885GRM5 3562/4885APP 1768/4885
US-20020132797-A1 DNA-cleaving antitumor agents DNASE1, DNASE1L3, DCLRE1B FFAR1 4220/4885GRM5 3972/4885APP 4231/4885

“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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