SCHEMBL4104400

SCHEMBL4104400

CN(C)CCON1C(=O)c2ccccc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.62
ALDH1A1 P00352 4/20 0.54
RECQL P46063 1/20 0.53
CYP1A2 P05177 2/20 0.49
TDP1 Q9NUW8 1/20 0.47
CYP2C9 P11712 1/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
HEXA P06865 1/20 0.45
HEXB P07686 1/20 0.45
HTR7 P34969 3/20 0.44
DRD2 P14416 2/20 0.44
HTR6 P50406 2/20 0.44
HTR1A P08908 1/20 0.44
HTR2A P28223 1/20 0.44
SLC6A4 P31645 1/20 0.44
HRH1 P35367 1/20 0.44
RET P07949 1/20 0.44
HTT P42858 1/20 0.43

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
SCHEMBL31208305 1.00 GAA (0.62) GAAALDH1A1RECQLCYP1A2TDP1
SCHEMBL20125239 0.86 GAA (0.59) GAAALDH1A1RECQLCYP1A2TDP1
SCHEMBL3485810 0.83 GAA (0.59) GAAALDH1A1RECQLCYP1A2TDP1
SCHEMBL22326350 0.82 GAA (0.88) GAAALDH1A1RECQLCYP1A2TDP1
SCHEMBL4917285 0.82 GAA (0.54) GAAALDH1A1RECQLCYP1A2TDP1
SCHEMBL1671882 0.82 GAA (0.54) GAAALDH1A1RECQLCYP1A2TDP1
Hydrochloric Acid SCHEMBL3485772 0.81 GAA (0.57) GAAALDH1A1RECQLCYP1A2TDP1
SCHEMBL10601228 0.81 MAOB (0.62) GAAALDH1A1
SCHEMBL2641485 0.80 HTR1B (0.43) GAAALDH1A1RECQLCYP1A2TDP1
SCHEMBL6625137 0.79 GAA (0.69) GAAALDH1A1RECQLCYP1A2TDP1

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
US-20240409533-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2024-12-12 US disclosed
US-12071433-B2 HMOX1 inducers Astellas Engineered Small Molecules US, Incorporated (US) 2024-08-27 US disclosed
US-20240051952-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2024-02-15 US disclosed
EP-3722291-B1 INDOLINONE COMPOUNDS AND THEIR USE IN THE TREATMENT OF FIBROTIC DISEASES RESPIVERT LTD (GB) 2023-07-19 EP disclosed
EP-3722291-B1 INDOLINONE COMPOUNDS AND THEIR USE IN THE TREATMENT OF FIBROTIC DISEASES RESPIVERT LTD (GB) 2023-07-19 EP disclosed
US-20220177460-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2022-06-09 US disclosed
US-20220177460-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2022-06-09 US disclosed
EP-3952990-A1 HMOX1 INDUCERS Mitobridge, Inc. (US) 2022-02-16 EP disclosed
CN-113874074-A HMOX1 inducers 米托布里奇公司 2021-12-31 CN disclosed
US-11046672-B2 Indolinones compounds and their use in the treatment of fibrotic diseases RESPIVERT LIMITED (GB) 2021-06-29 US disclosed
US-20140179691-A1 NOVEL OXAZOLIDINONE DERIVATIVE AND MEDICAL COMPOSITION CONTAINING SAME LEGOCHEM BIOSCIENCES, INC. (KR) 2014-06-26 US disclosed
US-8637667-B2 Method for preparing (S)-5-chloro-N-((3-(4-(5,6-dihydro-4H-1,2,4-oxadiazin-3-yl)phenyl)-2-oxooxazolidin-5-yl)methyl)thiophene-2-carboxamide derivatives LEGOCHEM BIOSCIENCE LTD. (KR) 2014-01-28 US disclosed
US-20120302516-A1 NANOPARTICLES FOR DRUG DELIVERY UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2012-11-29 US disclosed
US-20120108808-A1 METHOD FOR PREPARING (S)-5-CHLORO-N-((3-(4-(5,6-DIHYDRO-4H-1,2,4-OXADIAZIN-3-YL)PHENYL)-2-OXOOXAZOLIDIN-5-YL)METHYL)THIOPHENE-2-CARBOXAMIDE DERIVATIVES LEGOCHEM BIOSCIENCE LTD. (KR) 2012-05-03 US disclosed
US-20050203144-A1 Bicyclo[3.1.0]hexane containing oxazolidinone antibiotics and derivatives thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-09-15 US disclosed
EP-1385834-B1 BICYCLO[3,1,0]HEXANE CONTAINING OXAZOLIDINONE ANTIBIOTIC AND DERIVATIVES THEREOF MERCK & CO INC (US) 2005-09-14 EP disclosed
US-6897230-B2 Bicyclo[3/1/0] hexane containing oxazolidinone antibiotics and derivatives thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-05-24 US disclosed
EP-1385834-A1 BICYCLO[3,1,0]HEXANE CONTAINING OXAZOLIDINONE ANTIBIOTIC AND DERIVATIVES THEREOF Merck & Co., Inc. (US) 2004-02-04 EP disclosed
US-20030125367-A1 Bicyclo[3,1,0]hexane containing oxazolidinone antibioytics and derivatives thereof KYORIN PHARMACEUTICAL CO., LTD. 2003-07-03 US disclosed
WO-2003027083-A1 BICYCLO[3,1,0]HEXANE CONTAINING OXAZOLIDINONE ANTIBIOTIC AND DERIVATIVES THEREOF MERCK & CO., INC. (US) 2003-04-03 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 (10 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-20140179691-A1 NOVEL OXAZOLIDINONE DERIVATIVE AND MEDICAL COMPOSITION CONTAINING SAME OXA1L, PAM, ABCC1 GAA 1666/4885ALDH1A1 1667/4885RECQL 89/4885
US-20030125367-A1 Bicyclo[3,1,0]hexane containing oxazolidinone antibioytics and derivatives thereof NR4A1, NR0B1, NR1D1 GAA 4035/4885ALDH1A1 708/4885RECQL 1435/4885
US-20050203144-A1 Bicyclo[3.1.0]hexane containing oxazolidinone antibiotics and derivatives thereof NR0B1, NR4A1, VDR GAA 3705/4885ALDH1A1 741/4885RECQL 919/4885
US-20240409533-A1 HMOX1 INDUCERS HMOX1, HMOX2, HMBS GAA 2202/4885ALDH1A1 332/4885RECQL 3936/4885
US-12071433-B2 HMOX1 inducers HMOX1, HMOX2, HMBS GAA 2123/4885ALDH1A1 223/4885RECQL 3568/4885
US-20240051952-A1 HMOX1 INDUCERS HMOX1, HMOX2, QSOX1 GAA 1965/4885ALDH1A1 266/4885RECQL 3384/4885
US-20220177460-A1 HMOX1 INDUCERS HMOX1, HMOX2, HMBS GAA 2123/4885ALDH1A1 223/4885RECQL 3568/4885
US-11046672-B2 Indolinones compounds and their use in the treatment of fibrotic diseases IDO1, INMT, IDO2 GAA 3846/4885ALDH1A1 373/4885RECQL 1056/4885
US-20120108808-A1 METHOD FOR PREPARING (S)-5-CHLORO-N-((3-(4-(5,6-DIHYDRO-4H-1,2,4-OXADIAZIN-3-YL)PHENYL)-2-OXOOXAZOLIDIN-5-YL)METHYL)THIOPHENE-2-CARBOXAMIDE DERIVATIVES F2, F11, F5 GAA 2082/4885ALDH1A1 1161/4885RECQL 3836/4885
US-20120302516-A1 NANOPARTICLES FOR DRUG DELIVERY HIF1AN, CD47, EGLN2 GAA 2209/4885ALDH1A1 757/4885RECQL 3493/4885

“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.