SCHEMBL180816

SCHEMBL180816

O=[N+]([O-])c1ccc(Br)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
ADRA2A P08913 2/20 0.49
ADRA2B P18089 2/20 0.49
ADRA2C P18825 2/20 0.49
SLC2A1 P11166 1/20 0.49
LMNA P02545 4/20 0.48
KMT2A Q03164 4/20 0.47
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 3/20 0.47
CYP1A2 P05177 2/20 0.47
ALOX12 P18054 2/20 0.47
GAA P10253 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
KDM4E B2RXH2 2/20 0.46
AGTR1 P30556 1/20 0.46
HSPB1 P04792 2/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
HSP90AA1 P07900 1/20 0.45
CXCR5 P32302 1/20 0.45

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
SCHEMBL29655153 1.00 MAPT (0.49) MAPTADRA2AADRA2BADRA2CSLC2A1
Ethylene SCHEMBL27728659 0.96 MAPT (0.46) MAPTADRA2AADRA2BADRA2CSLC2A1
SCHEMBL17683527 0.78 FDFT1 (0.37) MAPTADRA2AADRA2BADRA2CSLC2A1
SCHEMBL14450630 0.78 MAPT (0.49) MAPTADRA2AADRA2BADRA2CSLC2A1
SCHEMBL3156019 0.77 MAPT (0.52) MAPTADRA2AADRA2BADRA2CSLC2A1
SCHEMBL29580092 0.76 MAPT (0.50) MAPTADRA2AADRA2BADRA2CSLC2A1
SCHEMBL202616 0.76 ADRA2A (0.55) MAPTADRA2AADRA2BADRA2CSLC2A1
SCHEMBL10936934 0.76 MAPT (0.50) MAPTADRA2AADRA2BADRA2CSLC2A1
SCHEMBL4892045 0.76 MAPT (0.50) MAPTADRA2AADRA2BADRA2CSLC2A1
SCHEMBL10113803 0.75 MAPT (0.43) MAPTADRA2AADRA2BADRA2CSLC2A1

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 1569 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122025743-A Low-temperature-resistant high-rate charge-discharge sodium ion startup and shutdown battery and preparation method thereof 江苏传艺科技股份有限公司 2026-05-12 CN claimed
CN-119684278-A Triphenylamine derivative and preparation method and application thereof 福建理工大学 2025-03-25 CN claimed
WO-2023027630-A9 A FLOW REACTOR, METHODS OF FABRICATION AND REACTIONS THEREOF NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-07-27 WO claimed
WO-2023027630-A2 A FLOW REACTOR, METHODS OF FABRICATION AND REACTIONS THEREOF NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-03-02 WO claimed
CN-112939829-B Synthetic method of aryl trifluoromethyl thioether 武汉药明康德新药开发有限公司 2023-02-21 CN claimed
CN-112961152-B Synthesis method of palbociclib impurity 北京新康哌森医药科技有限公司 2021-11-12 CN claimed
CN-112961152-A Synthesis method of palbociclib impurity 北京新康哌森医药科技有限公司 2021-06-15 CN claimed
CN-112939829-A Synthetic method of aryl trifluoromethyl thioether 武汉药明康德新药开发有限公司 2021-06-11 CN claimed
CN-109201010-A A kind of preparation method of the adsorbent material based on modified konjac glucomannan 陕西镇安华兴特色农产品开发有限公司 2019-01-15 CN claimed
CN-108164000-A Glass plate of fixed ammonia oxidizing bacteria and preparation method thereof 光合强化(北京)生物科技有限公司 2018-06-15 CN claimed
CN-103145763-A Novel ring metal ligand-platinum complex and preparation method and application thereof UNIV DALIAN TECH 2013-06-12 CN claimed
CN-103102301-A Preparation method of substituted pyridine-2-sulfonium salt UNIV NINGBO 2013-05-15 CN claimed
CN-102161711-B Method for preparing absorbing material based on modified konjac glucomannan UNIV SW SCI & TECH SWUST 2013-04-10 CN claimed
CN-102491968-A Method for preparing carbazolyl biaryl compound in water phase UNIV DALIAN TECH 2012-06-13 CN claimed
EP-2402317-A1 DGAT inhibitor Novartis AG (CH) 2012-01-04 EP claimed
CN-102161711-A Method for preparing absorbing material based on modified konjac glucomannan UNIV SW SCI & TECH SWUST 2011-08-24 CN claimed
CN-101948366-A Method for preparing 4- (diphenylamino) biaryl compound in water phase UNIV DALIAN TECH 2011-01-19 CN claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed