SCHEMBL2174053

SCHEMBL2174053

c1cnc(Nc2ncccn2)nc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
ACHE P22303 6/20 0.40
KDR P35968 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
HDAC8 Q9BY41 1/20 0.39
HSP90AA1 P07900 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PLAU P00749 1/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK10 P53779 1/20 0.38
GFER P55789 1/20 0.38
HTT P42858 2/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL3265738 0.78 MEN1 (0.58) ALDH1A1ACHEKDRKDM4EMEN1
SCHEMBL15968669 0.76 AURKA (0.63) ALDH1A1KDRKDM4EGAAMEN1
SCHEMBL911 0.76 AURKA (0.63) ALDH1A1KDRKDM4EGAAMEN1
Hydrochloric Acid SCHEMBL6820971 0.74 MAPK1 (0.61) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL5823445 0.74 RAD52 (0.48) KDRKDM4ENPC1MAPTRAB9A
SCHEMBL29544002 0.74 MEN1 (0.67) ALDH1A1KDRGAAMEN1KMT2A
Ammonia Solution, Strong SCHEMBL28789700 0.74 MAPT (0.61) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL6370265 0.74 AURKA (0.61) ALDH1A1KDRKDM4EGAAMEN1
SCHEMBL3951276 0.74 MEN1 (0.67) ALDH1A1KDRGAAMEN1KMT2A
SCHEMBL22978443 0.73 ADRA2A (0.52) ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116751200-A Tricyclic compounds containing substituted pyridones and methods of using the same 爱彼特生物制药公司 2023-09-15 CN claimed
CN-110114071-B Tricyclic compounds containing substituted pyridones and methods of using the same 爱彼特生物制药公司 2023-07-04 CN claimed
US-20220125771-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-04-28 US claimed
CN-113825756-A Substituted polycyclic carboxylic acids, analogs thereof, and methods of use thereof 爱彼特生物制药公司 2021-12-21 CN claimed
EP-3911653-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2021-11-24 EP claimed
US-20200261432-A1 SUBSTITUTED PYRIDINONE-CONTAINING TRYCYCLIC COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2020-08-20 US claimed
WO-2020150366-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2020-07-23 WO claimed
US-20190314347-A1 SUBSTITUTED PYRIDINONE-CONTAINING TRYCYCLIC COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA, INC. 2019-10-17 US claimed
EP-3534903-A1 SUBSTITUTED PYRIDINONE-CONTAINING TRICYCLIC COMPOUNDS, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2019-09-11 EP claimed
US-20250059178-A1 N-(PYRIDIN-2-YL)-4-(THIAZOL-5-YL)PYRIMIDIN-2-AMINE DERIVATIVES AS THERAPEUTIC COMPOUNDS Aucentra Thereapeutics Pty LTD (AU) 2025-02-20 US disclosed
US-20240052349-A1 TARGETED CONJUGATES COMPRISING MODIFIED SIRNA ARBUTUS BIOPHARMA CORPORATION (US) 2024-02-15 US disclosed
CN-116751200-A Tricyclic compounds containing substituted pyridones and methods of using the same 爱彼特生物制药公司 2023-09-15 CN disclosed
EP-4240369-A1 TARGETED CONJUGATES COMPRISING MODIFIED SIRNA Arbutus Biopharma Corporation (CA) 2023-09-13 EP disclosed
CN-116472063-A Targeted conjugates comprising modified siRNAs 阿布特斯生物制药公司 2023-07-21 CN disclosed
US-20080188452-A1 Macrocyclic Benzofused Pyrimidine Derivatives ABBVIE INC. 2008-08-07 US disclosed
WO-2008060767-A2 MACROCYCLIC BENZOFUSED PYRIMIDINE DERIVATIVES ABBOTT LABORATORIES (US) 2008-05-22 WO disclosed
EP-1899332-A1 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING HEPATITIS C. GILEAD SCIENCES, INC. (US) 2008-03-19 EP disclosed
WO-2006135993-A1 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING HEPATITIS C. GILEAD SCIENCES, INC. (US) 2006-12-28 WO disclosed
US-20060058178-A1 Aromatic compounds containing nitrogen and p- functionalized amines, the production thereof and their use in catalytic reactions DEGUSSA AG (DE) 2006-03-16 US disclosed
EP-1446224-B1 AROMATIC COMPOUNDS CONTAINING NITROGEN AND P-FUNCTIONALIZED AMINES, THE PRODUCTION THEREOF AND THEIR USE IN CATALYTIC REACTIONS DEGUSSA (DE) 2006-01-25 EP 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-20080188452-A1 Macrocyclic Benzofused Pyrimidine Derivatives DPYD, TYMS, UMPS ALDH1A1 411/4885ACHE 3918/4885KDR 2593/4885
US-20200261432-A1 SUBSTITUTED PYRIDINONE-CONTAINING TRYCYCLIC COMPOUNDS, AND METHODS USING SAME HAVCR2, HCCS, TYMP ALDH1A1 2110/4885ACHE 1724/4885KDR 3482/4885
US-20060058178-A1 Aromatic compounds containing nitrogen and p- functionalized amines, the production thereof and their use in catalytic reactions PAH, PNMT, TYR ALDH1A1 1612/4885ACHE 730/4885KDR 2728/4885
US-20240052349-A1 TARGETED CONJUGATES COMPRISING MODIFIED SIRNA SNRPE, AGO2, DCLRE1A ALDH1A1 1393/4885ACHE 4873/4885KDR 774/4885
US-20250059178-A1 N-(PYRIDIN-2-YL)-4-(THIAZOL-5-YL)PYRIMIDIN-2-AMINE DERIVATIVES AS THERAPEUTIC COMPOUNDS CDK4, CDK6, CDK2 ALDH1A1 3547/4885ACHE 4072/4885KDR 1398/4885
US-20190314347-A1 SUBSTITUTED PYRIDINONE-CONTAINING TRYCYCLIC COMPOUNDS, AND METHODS USING SAME HAVCR2, HCCS, TYMP ALDH1A1 2110/4885ACHE 1724/4885KDR 3482/4885
US-20220125771-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME SLC10A1, NR1H4, HDGF ALDH1A1 2459/4885ACHE 4729/4885KDR 4565/4885

“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.