SCHEMBL2958151

SCHEMBL2958151

N#Cc1ccc(N)cc1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
ALDH1A1 P00352 4/20 0.49
HPGD P15428 3/20 0.49
MAPT P10636 1/20 0.49
GALR3 O60755 1/20 0.46
GAA P10253 1/20 0.46
USP2 O75604 1/20 0.46
ADORA2A P29274 2/20 0.45
ADORA1 P30542 2/20 0.45
CYP19A1 P11511 1/20 0.44
LRRK2 Q5S007 1/20 0.44
MAOA P21397 3/20 0.44
MAOB P27338 2/20 0.44
LMNA P02545 1/20 0.43
ESR2 Q92731 1/20 0.43
HSD17B10 Q99714 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL16995319 0.85 ADORA1 (0.51) KDM4EALDH1A1HPGDMAPTADORA2A
SCHEMBL30533023 0.85 KDM4E (0.53) KDM4EALDH1A1HPGDMAPTGALR3
SCHEMBL22780766 0.85 KDM4E (0.53) KDM4EALDH1A1HPGDMAPTGALR3
SCHEMBL2959360 0.81 CYP11B1 (0.44) KDM4EALDH1A1HPGDMAPTGAA
SCHEMBL3528023 0.81 KDM4E (0.51) KDM4EALDH1A1HPGDMAPTGAA
SCHEMBL25699196 0.81 CYP19A1 (0.50) KDM4EALDH1A1HPGDMAPTGAA
SCHEMBL6625935 0.81 PTGDR2 (0.45) ALDH1A1HPGDMAPTMAOALMNA
SCHEMBL27297949 0.80 ALDH1A1 (0.49) KDM4EALDH1A1HPGDMAPTGALR3
SCHEMBL22420407 0.80 CYP11B1 (0.51) KDM4EALDH1A1HPGDMAPTGALR3
SCHEMBL5901013 0.79 ALDH1A1 (0.48) KDM4EALDH1A1HPGDMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11648234-B2 Selective androgen receptor degrader (SARD) ligands and methods of use UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2023-05-16 US disclosed
US-11648234-B2 Selective androgen receptor degrader (SARD) ligands and methods of use UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2023-05-16 US disclosed
US-11648234-B2 Selective androgen receptor degrader (SARD) ligands and methods of use UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2023-05-16 US disclosed
US-11591290-B2 Selective androgen receptor degrader (SARD) ligands and methods of use thereof UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2023-02-28 US disclosed
US-11591290-B2 Selective androgen receptor degrader (SARD) ligands and methods of use thereof UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2023-02-28 US disclosed
EP-3285757-B1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF ONCTERNAL THERAPEUTICS INC (US) 2021-09-22 EP disclosed
EP-3285757-B1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE THEREOF ONCTERNAL THERAPEUTICS INC (US) 2021-09-22 EP disclosed
US-20210161864-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2021-06-03 US disclosed
US-20210161864-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2021-06-03 US disclosed
CN-107735085-B Selective Androgen Receptor Degrader (SARD) ligands and methods of use thereof GTX公司 2021-05-14 CN disclosed
US-20080108649-A1 BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-08 US disclosed
US-20080108649-A1 BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-08 US disclosed
US-20080108649-A1 BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-08 US disclosed
WO-2008017381-A1 ARYLAMINOARYL-ALKYL-SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, PROCESSES FOR PREPARING THEM, MEDICAMENTS COMPRISING THESE COMPOUNDS, AND THEIR USE SANOFI-AVENTIS (FR) 2008-02-14 WO disclosed
WO-2008017381-A1 ARYLAMINOARYL-ALKYL-SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, PROCESSES FOR PREPARING THEM, MEDICAMENTS COMPRISING THESE COMPOUNDS, AND THEIR USE SANOFI-AVENTIS (FR) 2008-02-14 WO disclosed
EP-1506178-A4 BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION BRISTOL MYERS SQUIBB CO (US) 2006-05-24 EP disclosed
EP-1506178-A2 BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION Bristol-Myers Squibb Company (US) 2005-02-16 EP disclosed
US-20040181064-A1 Bicyclic modulators of androgen receptor function BRISTOL-MYERS SQUIBB COMPANY 2004-09-16 US disclosed
US-20040019063-A1 Bicyclic modulators of androgen receptor function BRISTOL-MYERS SQUIBB COMPANY 2004-01-29 US disclosed
WO-2003096980-A2 BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2003-11-27 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 (6 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-20040019063-A1 Bicyclic modulators of androgen receptor function AR, NR5A1, ESRRA KDM4E 1161/4885ALDH1A1 1211/4885HPGD 452/4885
US-20210161864-A1 SELECTIVE ANDROGEN RECEPTOR DEGRADER (SARD) LIGANDS AND METHODS OF USE AR, BRCA1, FSHR KDM4E 1046/4885ALDH1A1 1961/4885HPGD 2084/4885
US-11648234-B2 Selective androgen receptor degrader (SARD) ligands and methods of use AR, BRCA1, FSHR KDM4E 1046/4885ALDH1A1 1961/4885HPGD 2084/4885
US-20040181064-A1 Bicyclic modulators of androgen receptor function AR, NR5A1, ESRRA KDM4E 1539/4885ALDH1A1 1051/4885HPGD 441/4885
US-11591290-B2 Selective androgen receptor degrader (SARD) ligands and methods of use thereof AR, FSHR, UBE2V1 KDM4E 212/4885ALDH1A1 2132/4885HPGD 2209/4885
US-20080108649-A1 BICYCLIC MODULATORS OF ANDROGEN RECEPTOR FUNCTION AR, ESRRA, SHBG KDM4E 1108/4885ALDH1A1 1002/4885HPGD 290/4885

“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.