SCHEMBL21881999

SCHEMBL21881999

CCCC(CBr)CC(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
TRPA1 O75762 1/20 0.48
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
CYP3A4 P08684 2/20 0.37
ALOX15 P16050 2/20 0.37
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
HSD17B10 Q99714 2/20 0.36
CHRM1 P11229 1/20 0.36
ADORA1 P30542 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP1A2 P05177 1/20 0.34
LMNA P02545 2/20 0.33

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
SCHEMBL20225965 1.00 ALDH1A1 (0.48) ALDH1A1TRPA1MGAMGAASI
SCHEMBL9645840 0.89 ALDH1A1 (0.45) ALDH1A1TRPA1MGAMGAASI
SCHEMBL235094 0.88 MGAM (0.48) ALDH1A1TRPA1MGAMGAASI
SCHEMBL4075525 0.88 ALDH1A1 (0.50) ALDH1A1TRPA1MGAMGAASI
SCHEMBL3046232 0.87 ALDH1A1 (0.52) ALDH1A1TRPA1MGAMGAASI
SCHEMBL2959866 0.84 MGAM (0.44) ALDH1A1TRPA1MGAMGAASI
SCHEMBL15187255 0.82 MGAM (0.43) ALDH1A1TRPA1MGAMGAASI
SCHEMBL28070845 0.82 TSHR (0.36) ALDH1A1TRPA1MGAMGAASI
SCHEMBL28262928 0.82 MGAM (0.43) ALDH1A1TRPA1MGAMGAASI
SCHEMBL15187221 0.82 MGAM (0.43) ALDH1A1TRPA1MGAMGAASI

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115340482-B Synthesis method of brivaracetam 四川诺非特生物药业科技有限公司 2024-05-14 CN disclosed
CN-115340510-B Preparation method of brivaracetam intermediate 天津辰欣药物研究有限公司 2023-01-24 CN disclosed
CN-115340482-A Synthesis method of brivaracetam 四川诺非特生物药业科技有限公司 2022-11-15 CN disclosed
CN-115340510-A Preparation method of brivaracetam intermediate 天津辰欣药物研究有限公司 2022-11-15 CN disclosed
CN-114989061-A Preparation method of brivaracetam 江苏同禾药业有限公司 2022-09-02 CN disclosed
CN-111675643-B Preparation method of brivaracetam 浙江天宇药业股份有限公司 2021-10-26 CN disclosed
CN-111675643-A Preparation method of brivaracetam 浙江天宇药业股份有限公司 2020-09-18 CN disclosed
WO-2020051796-A1 PREPARATION METHOD FOR BRIVARACETAM AND INTERMEDIATE THEREOF 上海宣泰医药科技有限公司 2020-03-19 WO disclosed
WO-2020052545-A1 METHOD FOR PREPARING BRIVARACETAM AND INTERMEDIATES THEREOF 上海宣泰医药科技有限公司 2020-03-19 WO disclosed
CN-108503573-B A kind of new preparation method of Bu Waxitan 北京艾百诺医药股份有限公司 2019-11-22 CN disclosed
CN-108689903-A A kind of new preparation method of Bu Waxitan 北京艾百诺医药股份有限公司 2018-10-23 CN disclosed
CN-108503573-A A kind of new preparation method of Bu Waxitan 北京艾百诺医药股份有限公司 2018-09-07 CN disclosed