SCHEMBL2358722

SCHEMBL2358722

CCc1cn(CCOCCOCCOCCNC(C)=O)nn1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.38
DRD2 P14416 6/20 0.38
DGAT1 O75907 6/20 0.37
MMP2 P08253 2/20 0.37
MMP9 P14780 2/20 0.37
MMP8 P22894 2/20 0.37
MMP13 P45452 2/20 0.37
LGALS3 P17931 1/20 0.37
F2RL1 P55085 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 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
SCHEMBL22396008 0.89 DGAT1 (0.37) GBA1DRD2DGAT1MMP2MMP9
SCHEMBL16645298 0.88 GLS (0.42) GBA1DRD2DGAT1MMP2MMP9
SCHEMBL17625567 0.85 MAPK1 (0.39) GBA1
SCHEMBL15096376 0.83 GBA1 (0.37) GBA1DRD2DGAT1MMP2MMP9
SCHEMBL26770649 0.83 F2RL1 (0.40) DGAT1MMP2MMP9MMP8MMP13
SCHEMBL24450930 0.83 DGAT1 (0.39) GBA1DRD2DGAT1MMP2MMP9
SCHEMBL22151452 0.83 DGAT1 (0.39) DGAT1MMP2MMP9MMP8MMP13
SCHEMBL22151451 0.83 DGAT1 (0.39) DGAT1MMP2MMP9MMP8MMP13
SCHEMBL22300339 0.83 GBA1 (0.36) GBA1DRD2DGAT1MMP2MMP9
SCHEMBL22909211 0.82 GBA1 (0.42) GBA1MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230142803-A1 NATURAL KILLER CELLS AND ILC3 CELLS AND USES THEREOF CELULARITY INC. (US) 2023-05-11 US claimed
US-20210379033-A1 METHODS OF TREATING CANCER WITH ARYL HYDROCARBON RECEPTOR ANTAGONISTS EDIGENE BIOTECHNOLOGY, INC. (CN) 2021-12-09 US claimed
US-20210187033-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS NOVARTIS AG (CH) 2021-06-24 US claimed
US-10919900-B2 Aryl hydrocarbon receptor antagonists and uses thereof Magenta Therapeutics Inc. (US) 2021-02-16 US claimed
US-20200330516-A1 NATURAL KILLER CELLS AND USES THEREOF CELULARITY INC. (US) 2020-10-22 US claimed
US-20200123161-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND USES THEREOF EDIGENE BIOTECHNOLOGY, INC. (CN) 2020-04-23 US claimed
US-20190343885-A1 COMPOSITIONS AND METHODS FOR HEMATOPOIETIC STEM AND PROGENITOR CELL TRANSPLANT THERAPY EDIGENE BIOTECHNOLOGY, INC. (CN) 2019-11-14 US claimed
US-10457683-B2 Aryl hydrocarbon receptor antagonists and uses thereof Magenta Therapeutics Inc. (US) 2019-10-29 US claimed
EP-2788476-B1 COMPOSITIONS AND METHODS FOR ENHANCED GENERATION OF HEMATOPOIETIC STEM/PROGENITOR CELLS HUTCHINSON FRED CANCER RES (US) 2019-05-22 EP claimed
EP-2350078-B1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS NOVARTIS AG (CH) 2019-04-17 EP claimed
WO-2017066530-A1 NATURAL KILLER CELLS AND ILC3 CELLS AND USES THEREOF ANTHROGENSIS CORPORATION (US) 2017-04-20 WO claimed
US-9580426-B2 Compounds that expand hematopoietic stem cells NOVARTIS AG (CH) 2017-02-28 US claimed
WO-2016109661-A1 NATURAL KILLER CELLS AND USES THEREOF ANTHROGENESIS CORPORATION (US) 2016-07-07 WO claimed
US-20140369973-A1 COMPOSITIONS AND METHODS FOR ENHANCED GENERATION OF HEMATOPOIETIC STEM/PROGENITOR CELLS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2014-12-18 US claimed
EP-2788476-A1 COMPOSITIONS AND METHODS FOR ENHANCED GENERATION OF HEMATOPOIETIC STEM/PROGENITOR CELLS Fred Hutchinson Cancer Research Center (US) 2014-10-15 EP claimed
US-20140114070-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS THE SCRIPPS RESEARCH INSTITUTE (US) 2014-04-24 US claimed
WO-2013086436-A1 COMPOSITIONS AND METHODS FOR ENHANCED GENERATION OF HEMATOPOIETIC STEM/PROGENITOR CELLS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2013-06-13 WO claimed
EP-2350078-A2 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2011-08-03 EP claimed
US-20100183564-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2010-07-22 US claimed
WO-2010059401-A2 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS IRM LLC (BM) 2010-05-27 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 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-20140369973-A1 COMPOSITIONS AND METHODS FOR ENHANCED GENERATION OF HEMATOPOIETIC STEM/PROGENITOR CELLS AHR, NOTCH1, ARNT GBA1 4237/4885DRD2 2102/4885DGAT1 1637/4885
US-10457683-B2 Aryl hydrocarbon receptor antagonists and uses thereof AHR, ARNT, AIPL1 GBA1 3439/4885DRD2 1749/4885DGAT1 2724/4885
US-20210187033-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS CD47, HCLS1, CD74 GBA1 349/4885DRD2 4676/4885DGAT1 2259/4885
US-20190343885-A1 COMPOSITIONS AND METHODS FOR HEMATOPOIETIC STEM AND PROGENITOR CELL TRANSPLANT THERAPY MCL1, HCLS1, KIT GBA1 1135/4885DRD2 4813/4885DGAT1 1108/4885
US-20200123161-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND USES THEREOF AHR, ARNT, AIPL1 GBA1 3439/4885DRD2 1749/4885DGAT1 2724/4885
US-20210379033-A1 METHODS OF TREATING CANCER WITH ARYL HYDROCARBON RECEPTOR ANTAGONISTS AHR, ARNT, NCOR1 GBA1 2177/4885DRD2 3095/4885DGAT1 1595/4885
US-10919900-B2 Aryl hydrocarbon receptor antagonists and uses thereof AHR, ARNT, AIPL1 GBA1 3439/4885DRD2 1749/4885DGAT1 2724/4885
US-20200330516-A1 NATURAL KILLER CELLS AND USES THEREOF PBK, KLKB1, KLK13 GBA1 2493/4885DRD2 4647/4885DGAT1 3681/4885
US-20140114070-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS CD47, HCLS1, CD74 GBA1 349/4885DRD2 4676/4885DGAT1 2259/4885
US-20100183564-A1 COMPOUNDS THAT EXPAND HEMATOPOIETIC STEM CELLS CD47, HCLS1, CD74 GBA1 349/4885DRD2 4676/4885DGAT1 2259/4885
US-20230142803-A1 NATURAL KILLER CELLS AND ILC3 CELLS AND USES THEREOF PBK, ILF3, IL2 GBA1 3487/4885DRD2 4807/4885DGAT1 3773/4885

“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.