SCHEMBL3447352

SCHEMBL3447352

O=C(O)c1cc(-c2ccc(F)cc2)n[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALPL P05186 10/20 1.00
CA12 O43570 5/20 1.00
RPA1 P27694 1/20 1.00
TP53 P04637 1/20 0.72
CA9 Q16790 3/20 0.65
MARS1 P56192 1/20 0.58
HDAC3 O15379 4/20 0.57
HDAC4 P56524 4/20 0.57
HDAC1 Q13547 4/20 0.57
HDAC7 Q8WUI4 4/20 0.57
HDAC2 Q92769 4/20 0.57
HDAC10 Q969S8 4/20 0.57
HDAC11 Q96DB2 4/20 0.57
HDAC8 Q9BY41 4/20 0.57
HDAC6 Q9UBN7 4/20 0.57
HDAC9 Q9UKV0 4/20 0.57
HDAC5 Q9UQL6 4/20 0.57
KDM4E B2RXH2 1/20 0.56

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
SCHEMBL13539270 0.85 ALPL (0.73) ALPLCA12RPA1TP53CA9
SCHEMBL4638840 0.85 ALPL (0.73) ALPLCA12RPA1TP53HDAC3
SCHEMBL1414100 0.84 ALPL (1.00) ALPLCA12RPA1TP53CA9
SCHEMBL726574 0.84 TP53 (1.00) ALPLCA12RPA1TP53CA9
SCHEMBL28195524 0.83 ALPL (0.71) ALPLCA12RPA1TP53CA9
SCHEMBL23803931 0.83 ALPL (0.73) ALPLCA12RPA1TP53CA9
SCHEMBL15094586 0.83 ALPL (1.00) ALPLCA12RPA1TP53CA9
SCHEMBL645330 0.83 ALPL (1.00) ALPLCA12RPA1TP53CA9
SCHEMBL2566128 0.82 ALPL (0.69) ALPLCA12RPA1TP53CA9
SCHEMBL30147638 0.82 CHEK1 (0.72) ALPLCA12RPA1TP53HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-11 US disclosed
US-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-11 US disclosed
EP-4149945-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2023-03-22 EP disclosed
CN-115551864-A Substituted tricyclic amides, analogs thereof, and methods of using the same 爱彼特生物制药公司 2022-12-30 CN disclosed
WO-2021229302-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2021-11-18 WO disclosed
US-10377719-B2 Trypanosomes inhibitors HOFFMANN-LA ROCHE INC. (GB) 2019-08-13 US disclosed
EP-3380455-A1 TRYPANOSOMES INHIBITORS H. Hoffnabb-La Roche Ag (CH) 2018-10-03 EP disclosed
US-20180222866-A1 TRYPANOSOMES INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2018-08-09 US disclosed
CN-108368056-A Trypanosome inhibitor 豪夫迈·罗氏有限公司 2018-08-03 CN disclosed
WO-2017089389-A1 TRYPANOSOMES INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2017-06-01 WO disclosed
CN-104592116-B 1,3,5-trisubstituted pyrazole compounds, and preparation method and application thereof 山东大学 2017-01-11 CN disclosed
WO-2015069011-A1 NOVEL COMPOUND, METHOD FOR PREPARATION THEREOF, AND ANTIFUNGAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2015-05-14 WO disclosed
US-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-01-21 US disclosed
US-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-01-21 US disclosed
US-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-01-21 US 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 (4 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-20180222866-A1 TRYPANOSOMES INHIBITORS TPI1, SDHA, SDHB ALPL 4600/4885CA12 4516/4885RPA1 3664/4885
US-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME SLC10A1, NR1H4, SLC10A2 ALPL 1131/4885CA12 687/4885RPA1 2427/4885
US-20100016313-A1 INTESTINAL ALKALINE PHOSPHATASE MODULATORS AND USES THEREOF ALPI, SI, FABP2 ALPL 5/4885CA12 1444/4885RPA1 3119/4885
US-10377719-B2 Trypanosomes inhibitors TPI1, SDHA, SDHB ALPL 4600/4885CA12 4516/4885RPA1 3664/4885

“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.