SCHEMBL31021

SCHEMBL31021

c1ccc(Cn2ccc3ccccc32)cc1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.73
CDK4 P11802 4/20 0.63
CCND1 P24385 4/20 0.63
KMT2A Q03164 2/20 0.63
PLAU P00749 1/20 0.63
HDAC1 Q13547 1/20 0.59
HDAC2 Q92769 1/20 0.59
HDAC10 Q969S8 1/20 0.59
HDAC8 Q9BY41 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
HDAC9 Q9UKV0 1/20 0.59
POLB P06746 1/20 0.55
APP P05067 2/20 0.50
SNCA P37840 1/20 0.50

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
SCHEMBL29509279 1.00 HTR6 (0.73) HTR6CDK4CCND1KMT2APLAU
SCHEMBL6085799 0.89 HTR6 (0.70) HTR6CDK4CCND1KMT2APLAU
SCHEMBL2247137 0.86 HTR6 (0.72) HTR6CDK4CCND1KMT2APLAU
SCHEMBL29459650 0.86 HTR6 (0.72) HTR6CDK4CCND1KMT2APLAU
Naphthoquinone SCHEMBL28446215 0.85 HTR6 (0.56) HTR6CDK4CCND1KMT2APLAU
SCHEMBL6087734 0.85 HTR6 (0.70) HTR6CDK4CCND1KMT2APLAU
SCHEMBL21335591 0.85 HTR6 (0.70) HTR6CDK4CCND1KMT2APLAU
SCHEMBL22533706 0.85 HTR6 (0.65) HTR6CDK4CCND1KMT2APLAU
SCHEMBL2580966 0.85 HTR6 (0.70) HTR6CDK4CCND1KMT2APLAU
SCHEMBL257765 0.85 HTR6 (0.70) HTR6CDK4CCND1KMT2APLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119409615-A 2- (Indol-3-yl) phenol compound and synthesis method thereof 湘潭大学 2025-02-11 CN claimed
CN-117903161-A Tetrathiodiindole compound and derivative, synthetic method and application thereof 衡阳师范学院 2024-04-19 CN claimed
CN-115028655-B 2-trifluoromethyl-3-iodo-indole compound and preparation method thereof 上海大学 2024-01-16 CN claimed
CN-116969967-A Synthesis method of polysubstituted-5, 10-dihydro [1,2,3,4] tetrathio [5,6-b:7,8-b' ] diindole and derivative 衡阳师范学院 2023-10-31 CN claimed
CN-116924964-A Preparation method of tetrahydrocarbazole ring compound 四川轻化工大学 2023-10-24 CN claimed
CN-115028655-A 2-trifluoromethyl-3-iodine-indole compound and preparation method thereof 上海大学 2022-09-09 CN claimed
US-20220265775-A1 COMPOSITIONS AND METHODS FOR TREATING PULMONARY EDEMA OR LUNG INFLAMMATION UNIV MINNESOTA (US) 2022-08-25 US claimed
CN-109438318-B Synthesis method of 3-aryl indole and derivatives thereof 湖南医药学院 2022-05-03 CN claimed
CN-108658835-B Method for synthesizing indole-2-ketone compound 中国科学院成都有机化学有限公司 2021-12-03 CN claimed
CN-113564623-A Method for preparing isatin compound by electrochemically oxidizing N-substituted indole derivative 福建师范大学 2021-10-29 CN claimed
CN-1283637-C Substd. N-Benzyl-indol-3-yl glyoxylic acid derivs. having anti-tumoral effect ZENTARIS AG (DE) 2006-11-08 CN claimed
CN-1812151-A Erasible electronic bistable thin-film device and preparative method UNIV FUDAN (CN) 2006-08-02 CN claimed
US-6207696-B1 ADMINISTERING HUMAN FEMALE AT A TIME PRIOR TO MENSES OR AT COMMENCEMENT D-HISTIDINE, L-HISTIDINE, SALT OF HISTIDINE WHICH CAN BE REDUCED TO D- OR L-HISTIDINE, OR MIXTURES TO PREVENT ONSET OF DYSMENORRHEA OR TO TREAT SEQUELAE CYTOS PHARAMACEUTICALS, LLC 2001-03-27 US claimed
US-6033601-A POLYMERIZED FROM A 1-SUBSTITUTED, 3-SUBSTITUTED OR 1,3-SUBSTITUTED INDOLE MONOMER AND A GAS SENSOR CONTAINING THIS POLYMER AS THE ACTIVE GAS SENSING ELEMENT. AROMASCAN PLC (GB) 2000-03-07 US claimed
EP-0797769-A1 SEMICONDUCTING ORGANIC POLYMERS AROMASCAN PLC (GB) 1997-10-01 EP claimed
WO-1996018888-A1 SEMICONDUCTING ORGANIC POLYMERS AROMASCAN PLC (GB) 1996-06-20 WO claimed
US-5441956-A Analgesics, delta opioid receptor agonists SMITHKLINE BEECHAM FARMACEUTICI S.P.A. (IT) 1995-08-15 US claimed
EP-0596897-A1 HYDROISOQUINOLINE DERIVATIVES Smithkline Beecham Farmaceutici S.p.A. (IT) 1994-05-18 EP claimed
WO-1993001186-A1 HYDROISOQUINOLINE DERIVATIVES SMITHKLINE BEECHAM FARMACEUTICI S.P.A. (IT) 1993-01-21 WO claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed