SCHEMBL103328

SCHEMBL103328

CC(C)n1c(CCl)nc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.61
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
ALDH1A1 P00352 5/20 0.55
LMNA P02545 2/20 0.55
HSD17B10 Q99714 1/20 0.51
KDM4E B2RXH2 3/20 0.51
TSHR P16473 2/20 0.49
HPGD P15428 2/20 0.49
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
GLA P06280 1/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL7721500 0.84 POLB (0.63) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL859096 0.83 POLB (0.61) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL859880 0.83 POLB (0.61) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL6962681 0.82 POLB (0.47) POLBKMT2AMEN1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL30884529 0.81 MEN1 (0.51) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL20088741 0.80 POLB (0.71) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL9570011 0.80 POLB (0.58) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL9597754 0.80 ALDH1A1 (0.60) POLBKMT2AMEN1ALDH1A1LMNA
SCHEMBL103809 0.77 RAB9A (0.60) POLBKMT2AMEN1LMNAKDM4E
SCHEMBL1128688 0.77 SMN1; SMN2 (0.60) POLBKMT2AMEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63022091-A None JP disclosed
CN-114507246-B Benzimidazole substituted amino phenol oxygen zinc halide, and preparation method and application thereof 华东理工大学 2024-09-24 CN disclosed
CN-109879810-B Imidazole ring substituted aminophenol oxygen radical zinc complex and preparation method and application thereof 华东理工大学 2022-10-28 CN disclosed
CN-114507246-A Benzimidazole substituted aminophenoxy zinc halide and preparation method and application thereof 华东理工大学 2022-05-17 CN disclosed
US-8883826-B2 Alkynyl derivatives as modulators of metabotropic glutamate receptors ADDEX PHARMA SA (CH) 2014-11-11 US disclosed
US-8674106-B2 Alkynyl derivatives as modulators of metabotropic glutamate receptors ADDEX PHARMA SA (CH) 2014-03-18 US disclosed
US-20130178631-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2013-07-11 US disclosed
US-20120277237-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2012-11-01 US disclosed
EP-2426115-A2 Alkynyl derivatives as modulators of metabotropic glutamate receptors Addex Pharma SA (CH) 2012-03-07 EP disclosed
US-8101637-B2 Alkynyl derivatives as modulators of metatropic glutamate receptors ADDEX PHARMA SA (CH) 2012-01-24 US disclosed
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators ASTRAZENECA AB (SE) 2009-07-30 US disclosed
US-20090124625-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METATROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2009-05-14 US disclosed
WO-2007115077-A2 BICYCLIC BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2007-10-11 WO disclosed
EP-1765795-A2 ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharmaceuticals SA (CH) 2007-03-28 EP disclosed
WO-2005123703-A2 ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2005-12-29 WO disclosed
EP-0252507-B1 2-(4-PYRIDYLAMINOMETHYL)-BENZIMIDAZOLE DERIVATIVES HAVING ANTIVIRAL ACTIVITY Maruishi Seiyaku Kabushiki Kaisha (JP) 1990-10-10 EP disclosed
US-4818761-A VIRICIDES FOR COMMON COLD, HEPATITIS, POLIOMYELITIS MARUISHI SEIYAKU KABUSHIKI KAISHA (JP) 1989-04-04 US disclosed
JP-S6322091-A 2-(4-PYRIDYLAMINOMETHYL)-BENZIMIDAZOLE BASED DERIVATIVE HAVING ANTIVIRAL ACTIVITY MARUISHI SEIYAKU KK 1988-01-29 JP disclosed
EP-0252507-A1 2-(4-Pyridylaminomethyl)-benzimidazole derivatives having antiviral activity Maruishi Seiyaku Kabushiki Kaisha (JP) 1988-01-13 EP disclosed
JP-S06322091-A 0001-01-01 JP 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 (4 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-20130178631-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM5, GRM1, GRM2 POLB 4331/4885KMT2A 2181/4885MEN1 4118/4885
US-20090124625-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METATROPIC GLUTAMATE RECEPTORS GRM5, GRM2, GRM1 POLB 4543/4885KMT2A 1833/4885MEN1 3565/4885
US-20120277237-A1 NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM5, GRM1, GRM2 POLB 4331/4885KMT2A 2181/4885MEN1 4118/4885
US-20090192169-A1 Bicyclic Benzimidazole Compounds and Their Use as Metabotropic Glutamate Receptor Potentiators GRM1, GRIN1, GRM2 POLB 2103/4885KMT2A 1865/4885MEN1 3345/4885

“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.