SCHEMBL8514567

SCHEMBL8514567

O=C(NCc1ccccc1)C(Br)CBr

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
MMP8 P22894 2/20 0.53
MME P08473 1/20 0.49
TSHR P16473 2/20 0.49
GAA P10253 1/20 0.49
ALDH1A1 P00352 2/20 0.48
CYP2D6 P10635 2/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CACNA1C Q13936 1/20 0.48
SCN9A Q15858 1/20 0.48
CA9 Q16790 1/20 0.48
CA13 Q8N1Q1 1/20 0.48
CA14 Q9ULX7 1/20 0.48

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
SCHEMBL8568656 0.86 MMP8 (0.51) KMT2AMMP8MMETSHRGAA
SCHEMBL8568653 0.86 MMP8 (0.51) KMT2AMMP8MMETSHRGAA
SCHEMBL526281 0.86 KMT2A (0.53) KMT2AMMP8MMETSHRGAA
SCHEMBL526555 0.86 KMT2A (0.53) KMT2AMMP8MMETSHRGAA
SCHEMBL23754579 0.84 KMT2A (0.55) KMT2AMMP8MMEGAAALDH1A1
SCHEMBL2936657 0.84 KMT2A (0.55) KMT2AMMP8MMEGAAALDH1A1
SCHEMBL15610313 0.83 KMT2A (0.57) KMT2AMMP8MMETSHRGAA
SCHEMBL17617945 0.83 KMT2A (0.56) KMT2AGAAALDH1A1MEN1
SCHEMBL11380823 0.83 GAA (0.54) KMT2AMMP8GAAALDH1A1MEN1
SCHEMBL10638067 0.81 KMT2A (0.53) KMT2AMMP8MMEALDH1A1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3567027-B1 METHOD FOR PRODUCING N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND INTERMEDIATES THEREOF API CORP (JP) 2022-01-19 EP claimed
US-11136287-B2 Method for producing n-benzyl-2-bromo-3-methoxypropionamide and intermediates thereof API CORPORATION (JP) 2021-10-05 US claimed
US-20200115322-A1 METHOD FOR PRODUCING N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND INTERMEDIATES THEREOF API CORPORATION (JP) 2020-04-16 US claimed
EP-3567027-A1 N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND METHOD FOR PRODUCING INTERMEDIATE THEREOF API Corporation (JP) 2019-11-13 EP claimed
EP-3567027-B1 METHOD FOR PRODUCING N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND INTERMEDIATES THEREOF API CORP (JP) 2022-01-19 EP disclosed
US-11136287-B2 Method for producing n-benzyl-2-bromo-3-methoxypropionamide and intermediates thereof API CORPORATION (JP) 2021-10-05 US disclosed
US-11136287-B2 Method for producing n-benzyl-2-bromo-3-methoxypropionamide and intermediates thereof API CORPORATION (JP) 2021-10-05 US disclosed
US-20200115322-A1 METHOD FOR PRODUCING N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND INTERMEDIATES THEREOF API CORPORATION (JP) 2020-04-16 US disclosed
US-20200115322-A1 METHOD FOR PRODUCING N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND INTERMEDIATES THEREOF API CORPORATION (JP) 2020-04-16 US disclosed
EP-3567027-A1 N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND METHOD FOR PRODUCING INTERMEDIATE THEREOF API Corporation (JP) 2019-11-13 EP disclosed
EP-3567027-A1 N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND METHOD FOR PRODUCING INTERMEDIATE THEREOF API Corporation (JP) 2019-11-13 EP disclosed
WO-2018159028-A1 N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND METHOD FOR PRODUCING INTERMEDIATE THEREOF 株式会社エーピーアイ コーポレーション 2018-09-07 WO disclosed
US-20160081995-A1 Selective NR2B Antagonists BRISTOL MYERS SQUIBB CO (US) 2016-03-24 US disclosed
US-9221796-B2 Selective NR2B antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2015-12-29 US disclosed
US-20150191452-A1 Selective NR2B Antagonists BRISTOL-MYERS SQUIBB COMPANY 2015-07-09 US disclosed
US-20130317109-A1 PROCESS FOR THE PREPARATION OF LACOSAMIDE CAMBREX KARLSKOGA AB (SE) 2013-11-28 US disclosed
EP-2643293-A1 PROCESS FOR THE PREPARATION OF LACOSAMIDE Cambrex Karlskoga AB (SE) 2013-10-02 EP disclosed
WO-2013072933-A2 PROCESS FOR PREPARATION OF 2-ACETAMIDO-N-BENZYL-3-METHOXYPROPIONAMIDE GLENMARK GENERICS LIMITED (IN) 2013-05-23 WO disclosed
WO-2013072933-A2 PROCESS FOR PREPARATION OF 2-ACETAMIDO-N-BENZYL-3-METHOXYPROPIONAMIDE GLENMARK GENERICS LIMITED (IN) 2013-05-23 WO disclosed
WO-2012069855-A1 PROCESS FOR THE PREPARATION OF LACOSAMIDE CAMBREX KARLSKOGA AB (SE) 2012-05-31 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 (5 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-20200115322-A1 METHOD FOR PRODUCING N-BENZYL-2-BROMO-3-METHOXYPROPIONAMIDE AND INTERMEDIATES THEREOF NAAA, BRD2, PAM KMT2A 336/4885MMP8 1885/4885MME 142/4885
US-20150191452-A1 Selective NR2B Antagonists GRIN2B, GRIN2A, GRIN3A KMT2A 2824/4885MMP8 4044/4885MME 1271/4885
US-20130317109-A1 PROCESS FOR THE PREPARATION OF LACOSAMIDE NAAA, APEH, DNPEP KMT2A 551/4885MMP8 1600/4885MME 163/4885
US-11136287-B2 Method for producing n-benzyl-2-bromo-3-methoxypropionamide and intermediates thereof NAAA, BRD2, PAM KMT2A 336/4885MMP8 1885/4885MME 142/4885
US-20160081995-A1 Selective NR2B Antagonists GRIN2B, GRIN2A, GRIN3A KMT2A 2824/4885MMP8 4044/4885MME 1271/4885

“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.