SCHEMBL8070798

SCHEMBL8070798

N#CC1(CBr)C=CC=CC1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.33
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30

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
SCHEMBL10418779 0.75 HTR2A (0.34) KDM1AHTR2AHTR2CHTR2B
SCHEMBL31716197 0.72 CUL4A (0.35) KDM1A
SCHEMBL7312928 0.72 ALDH1A1 (0.36) KDM1A
SCHEMBL20520159 0.69 KDM1A (0.33) KDM1A
SCHEMBL16428784 0.69 ALDH1A1 (0.33) KDM1A
SCHEMBL3728489 0.69
SCHEMBL9842972 0.68
SCHEMBL1863590 0.67
SCHEMBL734440 0.66 KDM1A (0.38) KDM1AHTR2AHTR2CHTR2B
SCHEMBL20017698 0.66 HTR2A (0.35) KDM1AHTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118271246-A Method for continuously preparing 2-butyl-1, 3-diazaspiro [4.4] nonane-1-en-4-one 浙江华海药业股份有限公司 2024-07-02 CN claimed
CN-108732279-B Method for analyzing and determining genotoxic impurities in valsartan by using HPLC (high performance liquid chromatography) method 齐鲁制药有限公司 2022-07-08 CN claimed
CN-118271246-A Method for continuously preparing 2-butyl-1, 3-diazaspiro [4.4] nonane-1-en-4-one 浙江华海药业股份有限公司 2024-07-02 CN disclosed
CN-115215813-A Method for controlling valsartan impurity 江苏新瑞药业有限公司 2022-10-21 CN disclosed
CN-108732279-B Method for analyzing and determining genotoxic impurities in valsartan by using HPLC (high performance liquid chromatography) method 齐鲁制药有限公司 2022-07-08 CN disclosed
CN-108732279-B Method for analyzing and determining genotoxic impurities in valsartan by using HPLC (high performance liquid chromatography) method 齐鲁制药有限公司 2022-07-08 CN disclosed
CN-102145297-A Solid acid catalyst and method for catalytic synthesis of 5-substituted tetrazole by solid acid catalyst ZHEJIANG KINGLYUAN PHARMACEUTICAL COMPANY LTD 2011-08-10 CN disclosed
EP-1019048-A1 USE OF AN ANGIOTENSIN II RECEPTOR ANTAGONIST FOR THE PREPARATION OF DRUGS TO INCREASE THE SURVIVAL RATE OF RENAL TRANSPLANT PATIENTS Merck Sharp Dohme (Italia) S.P.A. (IT) 2000-07-19 EP disclosed
WO-1999016437-A1 USE OF AN ANGIOTENSIN II RECEPTOR ANTAGONIST FOR THE PREPARATION OF DRUGS TO INCREASE THE SURVIVAL RATE OF RENAL TRANSPLANT PATIENTS MERCK SHARP DOHME (ITALIA) S.P.A. (IT) 1999-04-08 WO disclosed