SCHEMBL4482068

SCHEMBL4482068

CCCOCCCCOCC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
THRB P10828 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 3/20 0.43
ALDH1A1 P00352 3/20 0.43
USP2 O75604 1/20 0.38
CYP3A4 P08684 1/20 0.37
HSD17B10 Q99714 1/20 0.36
CES2 O00748 1/20 0.36
SPHK2 Q9NRA0 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
EPHX2 P34913 1/20 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
SCHEMBL24412467 0.97 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL18902544 0.97 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL17137852 0.94 HTT (0.52) HTTMEN1THRBKMT2AMAPT
SCHEMBL627684 0.94 TSHR (0.43) HTTMEN1THRBKMT2AMAPT
SCHEMBL874663 0.94 TSHR (0.43) HTTMEN1THRBKMT2AMAPT
SCHEMBL3966692 0.92 HTT (0.56) HTTMEN1THRBKMT2AMAPT
SCHEMBL30143832 0.91 THRB (0.42) HTTMEN1THRBKMT2AMAPT
SCHEMBL25864715 0.91 THRB (0.42) HTTMEN1THRBKMT2AMAPT
SCHEMBL2551087 0.90 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL2473861 0.90 ALDH1A1 (0.50) HTTMEN1THRBKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230331681-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2023-10-19 US disclosed
US-20180072711-A1 INDOLE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS ARVINAS OPERATIONS, INC. 2018-03-15 US disclosed
US-20170327469-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2017-11-16 US disclosed
EP-1655291-B1 COMPOUNDS HAVING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO (JP) 2016-08-03 EP disclosed
US-20160214972-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR ARVINAS OPERATIONS, INC. 2016-07-28 US disclosed
US-9056043-B2 Dental compositions comprising ethylenically unsaturated addition-fragmentation agent 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-06-16 US disclosed
US-20090318513-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO., LTD. 2009-12-24 US disclosed
US-7601746-B2 Compounds exhibiting thrombopoietin receptor agonism SHIONOGI & CO., LTD. (JP) 2009-10-13 US disclosed
US-20070043087-A1 Such as 3-{2,6-difluoro-4-[4,5-dihydro-6-(3,3-dimethylbutyl)naphtho[1,2-d]thiazol-2-ylcabamoyl)phenyl]-2-methylacrylic acid EDDINGPHARM (HONG KONG) COMPANY LIMITED (CN) 2007-02-22 US disclosed
EP-1655291-A1 COMPOUNDS HAVING THROMBOPOIETIN RECEPTOR AGONISM SHIONOGI & CO., LTD. (JP) 2006-05-10 EP disclosed
CN-1228326-C Process for preparing N-alkenyl amides BASF AG (DE) 2005-11-23 CN disclosed
EP-1240139-B1 METHOD FOR PRODUCING N-ALKENYL AMIDES BASF AG (DE) 2005-11-09 EP disclosed
CN-1444552-A Method for producing alkenyl ethers BASF AG (DE) 2003-09-24 CN disclosed
US-6624303-B2 By reacting the corresponding NH-amides with acetylenes in the liquid phase using a basic alkali metal compound as catalyst and as cocatalyst (di- or tri-)1,4-butanediol mono- and diethers; N-vinyl-2-pyrrolidone from pyrrolidone BASF AKTIENGESELLSCHAFT (DE) 2003-09-23 US disclosed
EP-1268380-B1 METHOD FOR PRODUCING ALKENYL ETHERS BASF AG (DE) 2003-09-17 EP disclosed
US-20030114715-A1 Method for producing alkenyl ethers BOETTCHER ARND (DE) 2003-06-19 US disclosed
CN-1411443-A Method for producing N-alkenyl amides BASF AG (DE) 2003-04-16 CN disclosed
US-20030028035-A1 Method for producing n-alkenyl amides BASF AKTIENGESELLSCHAFT (DE) 2003-02-06 US disclosed
EP-1240139-A1 METHOD FOR PRODUCING N-ALKENYL AMIDES BASF AKTIENGESELLSCHAFT (DE) 2002-09-18 EP disclosed
WO-2001046139-A1 METHOD FOR PRODUCING N-ALKENYL AMIDES BASF AKTIENGESELLSCHAFT (DE) 2001-06-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160214972-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ESRRA, MDM2 HTT 1774/4885MEN1 3050/4885THRB 767/4885
US-20230331681-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, ADRM1, CRBN HTT 2521/4885MEN1 1674/4885THRB 654/4885
US-20180072711-A1 INDOLE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS ESR1, GPER1, ESR2 HTT 2699/4885MEN1 3530/4885THRB 365/4885
US-20170327469-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR AR, MDM2, ESRRA HTT 1845/4885MEN1 2815/4885THRB 639/4885
US-20090318513-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN RECEPTOR AGONISM MPL, TEK, GHRHR HTT 1255/4885MEN1 534/4885THRB 92/4885
US-20070043087-A1 Such as 3-{2,6-difluoro-4-[4,5-dihydro-6-(3,3-dimethylbutyl)naphtho[1,2-d]thiazol-2-ylcabamoyl)phenyl]-2-methylacrylic acid DHFR, NAT1, ACR HTT 1183/4885MEN1 245/4885THRB 2080/4885
US-20030028035-A1 Method for producing n-alkenyl amides NAT1, H1-2, H1-0 HTT 1544/4885MEN1 1890/4885THRB 2244/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.