SCHEMBL2173277

SCHEMBL2173277

c1ccc(-c2nc(-c3ccccc3)n(-c3ccccc3)c2-c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.65
ACHE P22303 1/20 0.65
MGAM O43451 4/20 0.51
GAA P10253 4/20 0.51
SI P14410 4/20 0.51
MGAM2 Q2M2H8 4/20 0.51
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HSP90AA1 P07900 1/20 0.46
MAPT P10636 1/20 0.46
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
AVPR1A P37288 1/20 0.44
HCAR1 Q9BXC0 1/20 0.44
PI4KA P42356 1/20 0.44
PI4K2B Q8TCG2 1/20 0.44
PI4K2A Q9BTU6 1/20 0.44
PI4KB Q9UBF8 1/20 0.44

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
Phosphine SCHEMBL28534966 0.98 BCHE (0.63) BCHEACHEMGAMGAASI
Bromide SCHEMBL28478160 0.98 BCHE (0.63) BCHEACHEMGAMGAASI
SCHEMBL2475314 0.94 BCHE (0.67) BCHEACHEMGAMGAASI
SCHEMBL31050815 0.92 BCHE (0.57) BCHEACHEMGAMGAASI
SCHEMBL28939710 0.90 ESR1 (0.57) BCHEACHEMGAMGAASI
SCHEMBL14280142 0.90 BCHE (0.56) BCHEACHEMGAMGAASI
SCHEMBL12425052 0.90 BCHE (0.55) BCHEACHEMGAMGAASI
SCHEMBL14690330 0.89 BCHE (0.55) BCHEACHEMGAMGAASI
SCHEMBL14690332 0.89 BCHE (0.55) BCHEACHEMGAMGAASI
SCHEMBL14280128 0.89 MGAM (0.55) BCHEACHEMGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119638672-A Organic fluorescent probe Tri-ATPM for detecting bromoxynil octanoate, and preparation method and application thereof 福建师范大学 2025-03-18 CN claimed
CN-119638671-A Organic fluorescent probe EDA-ATPM for detecting quizalofop-p-ethyl, and preparation method and application thereof 福建师范大学 2025-03-18 CN claimed
CN-118443923-B Cu-BTC@Ag NPs@TPE- (COOH)4Fluorescent probe for@DNA aptamer and preparation method and application thereof 中国热带农业科学院分析测试中心 2025-01-10 CN claimed
CN-118459408-A Fluorescent probe based on tetraphenyl imidazole derivative and preparation method and application thereof 福建师范大学 2024-08-09 CN claimed
CN-118443923-A Cu-BTC@Ag NPs@TPE- (COOH)4Fluorescent probe for@DNA aptamer and preparation method and application thereof 中国热带农业科学院分析测试中心 2024-08-06 CN claimed
CN-114790175-B Fluorescent probe for detecting glufosinate-ammonium and preparation method and application thereof 宁德师范学院 2023-05-19 CN claimed
CN-114790175-A Fluorescent probe for detecting glufosinate-ammonium as well as preparation method and application thereof 宁德师范学院 2022-07-26 CN claimed
CN-114031769-A Quaternary ammonium salt leveling agent, preparation method thereof, electroplating solution containing quaternary ammonium salt leveling agent and electroplating method 广州市慧科高新材料科技有限公司 2022-02-11 CN claimed
CN-108822084-B Tetraphenyl ethylene bridged tetraphenylimidazole salt and preparation method and application thereof 天津师范大学 2020-11-10 CN claimed
CN-109053689-B Tetrabenzimidazole salt compound and preparation method and application thereof 天津师范大学 2020-09-22 CN claimed
EP-2346919-B1 ISOCYANATE TRIMERISATION CATALYST SYSTEM, A PRECURSOR FORMULATION, A PROCESS FOR TRIMERISING ISOCYANATES, RIGID POLYISOCYANURATE/POLYURETHANE FOAMS MADE THEREFROM, AND A PROCESS FOR MAKING SUCH FOAMS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-09-04 EP claimed
US-20110201709-A1 ISOCYANATE TRIMERISATION CATALYST SYSTEM, A PRECURSOR FORMULATION, A PROCESS FOR TRIMERISING ISOCYANATES, RIGID POLYISOCYANURATE/POLYURETHANE FOAMS MADE THEREFROM, AND A PROCESS FOR MAKING SUCH FOAMS DOW GLOBAL TECHNOLOGIES LLC (US) 2011-08-18 US claimed
EP-2346919-A2 ISOCYANATE TRIMERISATION CATALYST SYSTEM, A PRECURSOR FORMULATION, A PROCESS FOR TRIMERISING ISOCYANATES, RIGID POLYISOCYANURATE/POLYURETHANE FOAMS MADE THEREFROM, AND A PROCESS FOR MAKING SUCH FOAMS Dow Global Technologies LLC (US) 2011-07-27 EP claimed
WO-2010054317-A2 AN ISOCYANATE TRIMERISATION CATALYST SYSTEM, A PRECURSOR FORMULATION, A PROCESS FOR TRIMERISING ISOCYANATES, RIGID POLYISOCYANURATE/POLYURETHANE FOAMS MADE THEREFROM, AND A PROCESS FOR MAKING SUCH FOAMS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-05-14 WO claimed
US-20080233438-A1 Fuel for fuel cell, fuel cell and application thereof KURITA WATER INDUSTRIES LTD. (JP) 2008-09-25 US claimed
US-7220294-B2 Forming ambient pressure and temperature, lightweight, transportable power source; contacting gas with organic compound in pressurized state KURITA WATER INDUSTRIES LTD. (JP) 2007-05-22 US claimed
CN-1894818-A Fuel for fuel cell, fuel cell and use thereof KURITA WATER IND LTD (JP) 2007-01-10 CN claimed
EP-1705740-A1 FUEL FOR FUEL CELL, FUEL CELL AND APPLICATION THEREOF Kurita Water Industries Ltd. (JP) 2006-09-27 EP claimed
US-20040230084-A1 Forming ambient pressure and temperature, lightweight, transportable power source; contacting gas with organic compound in pressurized state KURITA WATER INDUSTRIES LTD. (JP) 2004-11-18 US claimed
EP-1428831-A1 METHOD OF STORING HYDROGEN, HYDROGEN INCLUSION COMPOUND AND PROCESS FOR PRODUCING THE SAME KURITA WATER INDUSTRIES LTD. (JP) 2004-06-16 EP claimed

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-20110201709-A1 ISOCYANATE TRIMERISATION CATALYST SYSTEM, A PRECURSOR FORMULATION, A PROCESS FOR TRIMERISING ISOCYANATES, RIGID POLYISOCYANURATE/POLYURETHANE FOAMS MADE THEREFROM, AND A PROCESS FOR MAKING SUCH FOAMS PUF60, NOTUM, UFM1 BCHE 3097/4885ACHE 2022/4885MGAM 344/4885

“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.