SCHEMBL16706552

SCHEMBL16706552

Nc1nonc1/C(=N/O)Nc1ccc(F)c(Br)c1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 18/20 0.62
TDO2 P48775 2/20 0.49
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL29609391 1.00 IDO1 (0.62) IDO1TDO2POLBHPGD
SCHEMBL149915 1.00 IDO1 (0.62) IDO1TDO2POLBHPGD
SCHEMBL149916 1.00 IDO1 (0.62) IDO1TDO2POLBHPGD
SCHEMBL2520519 0.90 IDO1 (0.53) IDO1TDO2POLBHPGD
SCHEMBL2520514 0.90 IDO1 (0.53) IDO1TDO2POLBHPGD
SCHEMBL22062670 0.89 IDO1 (0.61) IDO1TDO2POLBHPGD
SCHEMBL21118296 0.88 IDO1 (0.50) IDO1TDO2POLBHPGD
SCHEMBL2516714 0.88 IDO1 (0.50) IDO1TDO2POLBHPGD
SCHEMBL2516716 0.88 IDO1 (0.50) IDO1TDO2POLBHPGD
SCHEMBL20090741 0.87 IDO1 (0.52) IDO1TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3389783-B1 NOVEL COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-07-03 EP disclosed
EP-3389783-B1 NOVEL COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-07-03 EP disclosed
CN-111943906-B Amidine derivatives, preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2023-12-15 CN disclosed
CN-115073442-A Disulfide bond-containing compound, preparation method thereof, pharmaceutical composition and application 中国医学科学院药物研究所 2022-09-20 CN disclosed
CN-108530444-B Novel NAMPT and IDO dual inhibitor and preparation method and medical application thereof 药康众拓(江苏)医药科技有限公司 2021-08-24 CN disclosed
US-11014895-B2 Heterocyclic urea compound, and drug composition and application thereof CHINA PHARMACEUTICAL UNIVERSITY (CN) 2021-05-25 US disclosed
EP-3744715-A1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR Incyte Holdings Corporation (US) 2020-12-02 EP disclosed
CN-111943906-A Amidine derivative, preparation method thereof, pharmaceutical composition and application 中国医学科学院药物研究所 2020-11-17 CN disclosed
EP-3677581-A1 DEUTERATED INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR AND APPLICATION THEREOF Nanjing Transthera Biosciences Co. Ltd. (CN) 2020-07-08 EP disclosed
EP-3066085-B1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR INCYTE HOLDINGS CORP (US) 2020-05-13 EP disclosed
WO-2017106062-A1 NOVEL COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-06-22 WO disclosed
US-9624185-B1 Method for preparing IDO inhibitor epacadostat XU YONG (US) 2017-04-18 US disclosed
US-9624185-B1 Method for preparing IDO inhibitor epacadostat XU YONG (US) 2017-04-18 US disclosed
US-20160221996-A1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR INCYTE CORPORATION 2016-08-04 US disclosed
US-20160221996-A1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR INCYTE CORPORATION 2016-08-04 US disclosed
US-9321755-B2 Process for the synthesis of an indoleamine 2,3-dioxygenase inhibitor INCYTE CORPORATION (US) 2016-04-26 US disclosed
US-9321755-B2 Process for the synthesis of an indoleamine 2,3-dioxygenase inhibitor INCYTE CORPORATION (US) 2016-04-26 US disclosed
WO-2015070007-A1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR INCYTE CORPORATION (US) 2015-05-14 WO disclosed
US-20150133674-A1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR INCYTE CORPORATION (US) 2015-05-14 US disclosed
US-20150133674-A1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR INCYTE CORPORATION (US) 2015-05-14 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 (3 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-20150133674-A1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR IDO1, INMT, IDO2 IDO1 1/4885TDO2 6/4885POLB 2652/4885
US-20160221996-A1 PROCESS FOR THE SYNTHESIS OF AN INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR IDO1, INMT, IDO2 IDO1 1/4885TDO2 6/4885POLB 2652/4885
US-11014895-B2 Heterocyclic urea compound, and drug composition and application thereof IDO1, IDO2, INMT IDO1 1/4885TDO2 21/4885POLB 3173/4885

“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.