SCHEMBL123581

SCHEMBL123581

Nc1nonc1-c1noc(=O)n1-c1ccc(F)c(Br)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.54
KCNK13 Q9HB14 4/20 0.36
RPS6KB1 P23443 5/20 0.35
GSK3B P49841 2/20 0.35
ROCK1 Q13464 2/20 0.35
PRKACA P17612 1/20 0.35
RPS6KA5 O75582 3/20 0.34
BCHE P06276 2/20 0.34
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL29376679 1.00 IDO1 (0.54) IDO1KCNK13RPS6KB1GSK3BROCK1
SCHEMBL20653617 0.89 IDO1 (0.44) IDO1KCNK13RPS6KB1GSK3BROCK1
SCHEMBL21326485 0.88 IDO1 (0.44) IDO1KCNK13RPS6KB1GSK3BROCK1
SCHEMBL16709409 0.87 IDO1 (0.42) IDO1RPS6KB1GSK3BROCK1PRKACA
SCHEMBL16706551 0.87 IDO1 (0.42) IDO1KCNK13RPS6KB1GSK3BROCK1
SCHEMBL29030690 0.86 IDO1 (0.42) IDO1RPS6KB1GSK3BROCK1PRKACA
SCHEMBL122395 0.86 IDO1 (0.42) IDO1KCNK13RPS6KB1GSK3BROCK1
SCHEMBL30449198 0.86 IDO1 (0.42) IDO1KCNK13RPS6KB1GSK3BROCK1
SCHEMBL21236133 0.86 IDO1 (0.52) IDO1NPSR1ALDH1A1HPGDALOX15
SCHEMBL20090775 0.85 IDO1 (0.61) IDO1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11192868-B2 Modulators of indoleamine 2,3-dioxygenase and methods of using the same INCYTE CORPORATION (US) 2021-12-07 US claimed
US-20190210985-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORPORATION 2019-07-11 US claimed
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
US-20240173303-A1 1,2,5-Oxadiazoles As Inhibitors Of Indoleamine 2,3- Dioxygenase INCYTE HOLDINGS CORPORATION 2024-05-30 US disclosed
EP-2911669-B1 SYNERGISTIC COMBINATION OF IMMUNOLOGIC INHIBITORS FOR THE TREATMENT OF CANCER UNIV CHICAGO (US) 2024-04-10 EP disclosed
EP-3730484-B1 INDOLEAMINE-2,3-DIOXYGENASE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF HINOVA PHARMACEUTICALS INC (CN) 2024-02-28 EP disclosed
CN-111116572-B Oxadiazole derivative, preparation method and application thereof 石药集团中奇制药技术(石家庄)有限公司 2023-10-27 CN disclosed
EP-3617198-B1 GUANIDINE DERIVATIVE LUNAN PHARMACEUTICAL GROUP CORP (CN) 2023-10-25 EP disclosed
CN-110139857-B Sulfoximine, sulfoximinamide, sulfodiimine, and diimine sulfonamide compounds as indoleamine 2,3-dioxygenase inhibitors 重庆复尚源创医药技术有限公司 2023-07-21 CN disclosed
CN-110343098-B Oxadiazole compound, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2023-05-26 CN disclosed
US-20100015178-A1 1,2,5-OXADIAZOLES AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION 2010-01-21 US disclosed
US-20100015178-A1 1,2,5-OXADIAZOLES AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION 2010-01-21 US disclosed
WO-2010005958-A2 1,2,5-OXADIAZOLES AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2010-01-14 WO disclosed
EP-1879573-A4 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORP (US) 2009-07-08 EP disclosed
EP-2016049-A1 3- (AMINOMETHYLIDEN) 2-INDOLINONE DERIVATIVES AND THEIR USE AS CELL PROLIFERATION INHIBITORS Boehringer Ingelheim International GmbH (DE) 2009-01-21 EP disclosed
EP-1879573-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME Incyte Corporation (US) 2008-01-23 EP disclosed
WO-2007122219-A1 3- (AMINOMETHYLIDEN) 2-INDOLINONE DERIVATIVES AND THEIR USE AS CELL PROLIFERATION INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-11-01 WO disclosed
WO-2006122150-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2006-11-16 WO disclosed
US-20060258719-A1 Modulators of indoleamine 2,3-dioxygenase and methods of using the same INCYTE CORPORATION 2006-11-16 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 (5 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-20240173303-A1 1,2,5-Oxadiazoles As Inhibitors Of Indoleamine 2,3- Dioxygenase IDO1, IDO2, INMT IDO1 1/4885KCNK13 2035/4885RPS6KB1 3984/4885
US-11192868-B2 Modulators of indoleamine 2,3-dioxygenase and methods of using the same IDO1, IDO2, INMT IDO1 1/4885KCNK13 4063/4885RPS6KB1 2699/4885
US-20100015178-A1 1,2,5-OXADIAZOLES AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, INMT IDO1 1/4885KCNK13 2035/4885RPS6KB1 3984/4885
US-20060258719-A1 Modulators of indoleamine 2,3-dioxygenase and methods of using the same IDO1, IDO2, INMT IDO1 1/4885KCNK13 4063/4885RPS6KB1 2699/4885
US-20190210985-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME IDO1, IDO2, INMT IDO1 1/4885KCNK13 4063/4885RPS6KB1 2699/4885

“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.