SCHEMBL1134831

SCHEMBL1134831

Cn1cc(C(=O)Nc2ccccc2-c2ccc(Br)cc2)c(C(F)F)n1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.49
LMNA P02545 3/20 0.48
POLB P06746 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NTRK1 P04629 1/20 0.43
ALDH1A1 P00352 3/20 0.41
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
TP53 P04637 1/20 0.41
IRAK4 Q9NWZ3 6/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
AURKA O14965 1/20 0.40
ADORA3 P0DMS8 1/20 0.39

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
SCHEMBL20875262 0.91 NTRK1 (0.52) ATMLMNANTRK1ALDH1A1HTT
SCHEMBL1145015 0.91 ATM (0.46) ATMLMNAPOLBNPSR1NTRK1
SCHEMBL1085490 0.91 ALDH1A1 (0.50) ATMLMNAPOLBNPSR1ALDH1A1
SCHEMBL10060307 0.90 LMNA (0.50) ATMLMNAPOLBNPSR1NTRK1
SCHEMBL121957 0.89 TDP1 (0.53) ATMLMNAPOLBNPSR1NTRK1
SCHEMBL29419144 0.89 TDP1 (0.53) ATMLMNAPOLBNPSR1NTRK1
SCHEMBL4095614 0.88 ATM (0.43) ATMLMNANTRK1ALDH1A1HTT
SCHEMBL4793286 0.88 CHRM3 (0.48) ATMLMNANTRK1ALDH1A1HTT
SCHEMBL527999 0.87 ATM (0.45) ATMLMNANTRK1ALDH1A1HTT
SCHEMBL10061459 0.87 NTRK1 (0.48) ATMLMNANTRK1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102015649-B Method for producing aryl carboxamides BASF SE 2013-06-19 CN claimed
EP-2285779-B1 Method for manufacturing aryl carboxamides BASF SE (DE) 2013-03-27 EP claimed
US-8350046-B2 Method for manufacturing aryl carboxamides BASF SE (DE) 2013-01-08 US claimed
CN-102015649-A Method for producing aryl carboxamides BASF SE 2011-04-13 CN claimed
US-20110054183-A1 Method For Manufacturing Aryl Carboxamides BASF SE 2011-03-03 US claimed
EP-2285779-A1 METHOD FOR MANUFACTURING ARYL CARBOXAMIDES BASF SE (DE) 2011-02-23 EP claimed
WO-2009135860-A1 METHOD FOR MANUFACTURING ARYL CARBOXAMIDES BASF SE (DE) 2009-11-12 WO claimed
CN-113788790-B Aromatic heterocyclic amide derivative and application thereof 华东理工大学 2025-02-18 CN disclosed
EP-2300417-B1 PROCESS FOR PREPARING 2-(AMINOMETHYLIDENE)-4,4-DIFLUORO-3-OXOBUTYRIC ESTERS BASF SE (DE) 2015-07-22 EP disclosed
EP-2496560-B1 PROCESS FOR PREPARING 1,3-DISUBSTITUTED PYRAZOLE COMPOUNDS BASF SE (DE) 2015-04-22 EP disclosed
EP-2288597-B1 METHOD FOR PREPARING 1,3,4-SUBSTITUTED PYRAZOL COMPOUNDS BASF SE (DE) 2014-10-29 EP disclosed
EP-2496561-B1 PROCESS FOR PREPARING AMINALE AND THEIR USE FOR PREPARING 1,3-DISUBSTITUTED PYRAZOLE COMPOUNDS BASF SE (DE) 2014-06-04 EP disclosed
US-8598222-B2 Method for preparing 1,3,4-substituted pyrazol compounds BASF SE (DE) 2013-12-03 US disclosed
US-20100184994-A1 Method for Producing Difluoromethyl-Substituted Pyrazole Compounds BASF SE (DE) 2010-07-22 US disclosed
EP-2158185-A2 METHOD FOR PRODUCING DIFLUOROMETHYL-SUBSTITUTED PYRAZOLE COMPOUNDS Basf Se (DE) 2010-03-03 EP disclosed
WO-2009135860-A1 METHOD FOR MANUFACTURING ARYL CARBOXAMIDES BASF SE (DE) 2009-11-12 WO disclosed
WO-2009135808-A2 METHOD FOR PREPARING 1,3,4-SUBSTITUTED PYRAZOL COMPOUNDS BASF SE (DE) 2009-11-12 WO disclosed
WO-2009133178-A1 PROCESS FOR PREPARING 2-(AMINOMETHYLIDENE)-4,4-DIFLUORO-3-OXOBUTYRIC ESTERS BASF SE (DE) 2009-11-05 WO disclosed
WO-2009133179-A2 METHOD FOR THE PRODUCTION OF HALOGEN-SUBSTITUTED 2-(AMINOMETHYLIDENE)-3- OXOBUTYRIC ACID ESTERS BASF SE (DE) 2009-11-05 WO disclosed
WO-2008152138-A2 METHOD FOR PRODUCING DIFLUOROMETHYL-SUBSTITUTED PYRAZOLE COMPOUNDS BASF SE (DE) 2008-12-18 WO 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 (2 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-20110054183-A1 Method For Manufacturing Aryl Carboxamides H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR3, CBR1 ATM 3784/4885LMNA 2595/4885POLB 1691/4885
US-20100184994-A1 Method for Producing Difluoromethyl-Substituted Pyrazole Compounds NR4A1, NR4A3, NR3C1 ATM 4646/4885LMNA 654/4885POLB 1758/4885

“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.