SCHEMBL23829919

SCHEMBL23829919

O=[N+]([O-])c1ccnc(F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
HIF1A Q16665 1/20 0.47
TSHR P16473 4/20 0.46
LMNA P02545 1/20 0.46
PDE4D Q08499 1/20 0.43
CYP3A4 P08684 1/20 0.42
NAMPT P43490 1/20 0.42
XDH P47989 1/20 0.42
TDP1 Q9NUW8 4/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 2/20 0.40
TXNRD1 Q16881 1/20 0.40
TXNRD3 Q86VQ6 1/20 0.40
TXNRD2 Q9NNW7 1/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PTPRC P08575 1/20 0.39
S100A4 P26447 1/20 0.39
ACHE P22303 1/20 0.39
LOXL2 Q9Y4K0 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
SCHEMBL30389430 0.98 ALDH1A1 (0.46) ALDH1A1HIF1ATSHRLMNAPDE4D
SCHEMBL27462210 0.81 PDE4B (0.40) ALDH1A1HIF1ATSHRLMNAPDE4D
SCHEMBL3143209 0.79 TSHR (0.46) ALDH1A1TSHRLMNAPDE4DCYP3A4
SCHEMBL29979690 0.79 TSHR (0.46) ALDH1A1TSHRLMNAPDE4DCYP3A4
SCHEMBL826630 0.78 TSHR (0.50) ALDH1A1TSHRLMNACYP3A4NAMPT
Ammonia Solution, Strong SCHEMBL28271262 0.78 TSHR (0.45) ALDH1A1TSHRLMNAPDE4DCYP3A4
SCHEMBL26310123 0.77 ROCK1 (0.58) ALDH1A1LMNAMAPTGAA
SCHEMBL28720537 0.77 TSHR (0.48) ALDH1A1TSHRLMNACYP3A4NAMPT
SCHEMBL3311690 0.75 ALDH1A1 (0.48) ALDH1A1TSHRLMNAPDE4DCYP3A4
SCHEMBL7942312 0.75 GAA (0.50) ALDH1A1TSHRLMNACYP3A4NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108067233-A Improve foam nickel-base catalyst of sludge hot hydrolysis efficiency and preparation method thereof 北京达源环保科技有限公司 2018-05-25 CN claimed
CN-107879583-A Sludge pyrohydrolysis and anaerobic digestion integrated treatment process system 北京达源环保科技有限公司 2018-04-06 CN claimed
US-20210289794-A1 COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-23 US disclosed
CN-107074854-B Imidazo [4, 5-c ] pyridine derived SSAO inhibitors 普罗克斯马根有限责任公司 2019-07-19 CN disclosed
CN-106029076-B Benzo piperazine composition as BET bromine domain inhibitor 福马疗法公司 2019-06-07 CN disclosed
CN-109071504-A Inhibitors of receptor interacting protein kinase 1 戴纳立制药公司 2018-12-21 CN disclosed
CN-207987003-U Sludge pyrohydrolysis and anaerobic digestion integrated treatment process system 北京达源环保科技有限公司 2018-10-19 CN disclosed
CN-108067233-A Improve foam nickel-base catalyst of sludge hot hydrolysis efficiency and preparation method thereof 北京达源环保科技有限公司 2018-05-25 CN disclosed
CN-107879583-A Sludge pyrohydrolysis and anaerobic digestion integrated treatment process system 北京达源环保科技有限公司 2018-04-06 CN disclosed
CN-107108512-A Therapeutic compound and application thereof 基因泰克公司 2017-08-29 CN disclosed
CN-107074853-A The pyridine derived SSAO inhibitor of imidazo [4,5 c] 普罗克斯马根有限公司 2017-08-18 CN disclosed
CN-107074854-A Imidazo [4, 5-c ] pyridine derived SSAO inhibitors 普罗克斯马根有限公司 2017-08-18 CN disclosed
CN-106715428-A Pesticidally active tetracyclic derivatives with sulphur containing substituents 先正达参股股份有限公司 2017-05-24 CN disclosed
CN-105189494-B Imidazo[4,5-c]pyridine and pyrrolo[2,3-c]pyridine derivatives as SSAO inhibitors 普罗克西梅根有限公司 2017-04-26 CN disclosed
CN-105189494-A Imidazo[4,5-c]pyridine and pyrrolo[2,3-c]pyridine derivatives as SSAO inhibitors PROXIMAGEN LTD 2015-12-23 CN disclosed
CN-103097381-B As 1,8-naphthyridines material of kinase inhibitor MERCK PATENT GMBH (DE) 2015-10-07 CN disclosed
CN-102869359-A Imidazopyridine and purine compounds, compositions, and methods of use HOFFMANN LA ROCHE 2013-01-09 CN disclosed