SCHEMBL2097210

SCHEMBL2097210

CCCCNc1ccc(OC)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.73
MAPT P10636 4/20 0.73
ALDH1A1 P00352 1/20 0.58
PPARG P37231 1/20 0.55
APP P05067 1/20 0.51
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 1/20 0.50
THRB P10828 1/20 0.50
MAPK1 P28482 1/20 0.50
RECQL P46063 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PTPN1 P18031 1/20 0.47

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
SCHEMBL11331749 0.94 GAA (0.70) GAAMAPTALDH1A1PPARGAPP
SCHEMBL11327473 0.92 GAA (0.68) GAAMAPTALDH1A1PPARGAPP
SCHEMBL11335452 0.92 GAA (0.68) GAAMAPTALDH1A1PPARGAPP
SCHEMBL11333048 0.92 GAA (0.68) GAAMAPTALDH1A1PPARGAPP
SCHEMBL3631474 0.92 GAA (0.68) GAAMAPTALDH1A1PPARGAPP
SCHEMBL11225712 0.92 GAA (0.68) GAAMAPTALDH1A1PPARGAPP
SCHEMBL7001977 0.92 GAA (0.68) GAAMAPTALDH1A1PPARGAPP
SCHEMBL11338984 0.92 GAA (0.68) GAAMAPTALDH1A1PPARGAPP
Cyclopropane SCHEMBL28852061 0.89 GAA (0.63) GAAMAPTALDH1A1PPARGAPP
SCHEMBL613598 0.88 GAA (0.79) GAAMAPTALDH1A1PPARGAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104370759-B A kind of preparation method of deuterated dimethyl Ractopamine hydrochloride SHANGHAI INSTITUTE OF TECHNOLOGY (CN) 2016-04-27 CN claimed
CN-104370759-A Preparation method of deuterated dimethyl ractopamine SHANGHAI INST TECHNOLOGY 2015-02-25 CN claimed
CN-115448909-B N-carbazolyl-1H-pyrrole-2-carboxamide and application thereof as ligand in copper-catalyzed C-N coupling reaction 中山大学 2023-10-27 CN disclosed
EP-3812040-B1 COMPLEXES JOHNSON MATTHEY PLC (GB) 2023-01-11 EP disclosed
CN-115448909-A N-carbazolyl-1H-pyrrole-2-formamide and application thereof as ligand in copper-catalyzed C-N coupling reaction 中山大学 2022-12-09 CN disclosed
CN-110201721-B Complex compounds 庄信万丰股份有限公司 2022-07-22 CN disclosed
CN-109456205-B N-arylation method in aqueous phase system by using substituted quinoline or isoquinoline hydrazide pyridine-N-oxide as ligand 石河子大学 2021-09-21 CN disclosed
EP-3812040-A1 COMPLEXES Johnson Matthey Public Limited Company (GB) 2021-04-28 EP disclosed
EP-3154689-B1 COMPLEXES JOHNSON MATTHEY PLC (GB) 2021-01-27 EP disclosed
CN-106661071-B Complex compounds 庄信万丰股份有限公司 2020-06-09 CN disclosed
CN-109456205-A Using substd quinolines or isoquinolin hydrazides pyridine-N-oxides as the N- arylation method in the aqueous phase system of ligand 石河子大学 2019-03-12 CN disclosed
US-20070123707-A1 Nitrogen-containing monodentate phosphines and their use in catalysis DEGUSSA AG (DE) 2007-05-31 US disclosed
WO-2006084246-A2 AROMATIC AMIDES AND UREAS AND THEIR USES AS SWEET AND/OR UMAMI FLAVOR MODIFIERS, TASTANTS AND TASTE ENHANCERS SENOMYX, INC. (US) 2006-08-10 WO disclosed
EP-1659881-A2 NOVEL FLAVORS, FLAVOR MODIFIERS, TASTANTS, TASTE ENHANCERS, UMAMI OR SWEET TASTANTS, AND/OR ENHANCERS AND USE THEREOF Senomyx Inc. (US) 2006-05-31 EP disclosed
WO-2005041684-A2 NOVEL FLAVORS, FLAVOR MODIFIERS, TASTANTS, TASTE ENHANCERS, UMAMI OR SWEET TASTANTS, AND/OR ENHANCERS AND USE THEREOF SENOMYX INC. (US) 2005-05-12 WO disclosed
EP-0612724-B1 Substituted benzenesulfonylureas and -thioureas, process for their preparation and their use as pharmaceuticals HOECHST AG (DE) 1996-12-27 EP disclosed
EP-0612724-A1 Substituted benzenesulfonylureas and -thioureas, process for their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1994-08-31 EP disclosed
EP-0002721-B1 PROCESS FOR PREPARING HYDRAZINES BAYER AG (DE) 1981-09-02 EP disclosed
EP-0002721-A2 Process for preparing hydrazines BAYER AG (DE) 1979-07-11 EP disclosed
US-4076849-A AROMATIC SECONDARY AMINES CANADA PACKERS LIMITED (CA) 1978-02-28 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-20070123707-A1 Nitrogen-containing monodentate phosphines and their use in catalysis HDHD5, PNP, PHOSPHO1 GAA 3420/4885MAPT 3766/4885ALDH1A1 3129/4885

“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.