SCHEMBL958138

SCHEMBL958138

C=CCn1ccc(=O)c(O)c1C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
TP53 P04637 1/20 0.55
CYP2D6 P10635 1/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
KDM6A O15550 1/20 0.50
KDM4A O75164 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
KDM5C P41229 1/20 0.50
KDM2B Q8NHM5 1/20 0.50
DOHH Q9BU89 1/20 0.50
KDM2A Q9Y2K7 1/20 0.50
APP P05067 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
COMT P21964 2/20 0.44
MAOB P27338 7/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38

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
SCHEMBL20386661 0.84 KDM4E (0.57) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL10480769 0.83 KDM4E (0.42) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL8716751 0.83 KDM4E (0.55) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL878561 0.81 KDM4E (0.40) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL2837599 0.80 KDM4E (0.53) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL5525055 0.78 KDM4E (0.62) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL3083137 0.77 KDM4E (0.61) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL13003558 0.77 KDM4E (0.60) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL4394165 0.75 KDM4E (0.58) KDM4ETP53CYP2D6HTTSMN1; SMN2
SCHEMBL9513592 0.75 APP (0.61) KDM4ETP53CYP2D6HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE50230-E1 Method of treatment of hypoxia inducible factor (HIF)-related conditions GRIFOLS WORLDWIDE OPERATIONS LIMITED (IE) 2024-12-10 US claimed
WO-1989009211-A1 PROCESS FOR PRODUCING PYRID-4-ONES THE ROYAL FREE HOSPITAL SCHOOL OF MEDICINE (GB) 1989-10-05 WO claimed
EP-0335745-A1 Process for producing pyrid-4-ones THE ROYAL FREE HOSPITAL SCHOOL OF MEDICINE (GB) 1989-10-04 EP claimed
US-RE50230-E1 Method of treatment of hypoxia inducible factor (HIF)-related conditions GRIFOLS WORLDWIDE OPERATIONS LIMITED (IE) 2024-12-10 US disclosed
US-11826353-B2 Method and system for treating cancer TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2023-11-28 US disclosed
US-11759453-B2 SHMT inhibitors THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2023-09-19 US disclosed
US-20230100559-A1 Compositions and Methods for Treatment of Disease by Manipulation of Serine Metabolism THE TRUSTEES OF PRINCETON UNIVERSITY 2023-03-30 US disclosed
US-11369588-B2 NADPH production by the 10-formyl-THF pathway, and its use in the diagnosis and treatment of disease THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2022-06-28 US disclosed
US-20190336583-A1 COMPOSITIONS AND METHODS FOR TREATING IRON OVERLOAD LA JOLLA PHARMACEUTICAL COMPANY 2019-11-07 US disclosed
WO-2018136636-A1 COMPOSITIONS AND METHODS FOR TREATING IRON OVERLOAD LA JOLLA PHARMACEUTICAL COMPANY (US) 2018-07-26 WO disclosed
EP-2665493-B1 MRI MARKERS, DELIVERY AND EXTRACTION SYSTEMS, AND METHODS OF MANUFACTURE AND USE THEREOF UNIV TEXAS (US) 2018-03-21 EP disclosed
CN-1252079-C Substance with physiological activity, its preparation method and application AMINO UP CHEMICAL CO LTD (JP) 2006-04-19 CN disclosed
US-20050143341-A1 Novel substance having physiological property, method for producing the same and uses thereof AMINO UP CHEMICAL CO., LTD. 2005-06-30 US disclosed
US-6831067-B2 Glucosides containing isomaltol as an aglycon produced reacting a basidiomycete culture solution with the reaction product of rice bran extracts and an enzyme AMINO UP CHEMICAL CO., LTD. (JP) 2004-12-14 US disclosed
CN-1422277-A Substance with physiological activity, its preparation method and application AMINO UP CHEMICAL CO LTD (JP) 2003-06-04 CN disclosed
EP-1298137-A1 NOVEL SUBSTANCE HAVING PHYSIOLOGICAL ACTIVITY, PROCESS FOR PRODUCING THE SAME, AND USE AMINO UP CHEMICAL CO. LTD. (JP) 2003-04-02 EP disclosed
US-20030045483-A1 Novel substance having physiological activity, process for producing the same, and use Amino Up Co., Ltd. (JP) 2003-03-06 US disclosed
US-5336482-A Diagnostic scintigraphic imaging THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-08-09 US disclosed
WO-1989009211-A1 PROCESS FOR PRODUCING PYRID-4-ONES THE ROYAL FREE HOSPITAL SCHOOL OF MEDICINE (GB) 1989-10-05 WO disclosed
EP-0335745-A1 Process for producing pyrid-4-ones THE ROYAL FREE HOSPITAL SCHOOL OF MEDICINE (GB) 1989-10-04 EP 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 (6 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-11759453-B2 SHMT inhibitors SHMT1, SHMT2, BHMT KDM4E 229/4885TP53 103/4885CYP2D6 2358/4885
US-11369588-B2 NADPH production by the 10-formyl-THF pathway, and its use in the diagnosis and treatment of disease MTHFD1, DPYD, MTHFD2 KDM4E 2103/4885TP53 1993/4885CYP2D6 715/4885
US-20230100559-A1 Compositions and Methods for Treatment of Disease by Manipulation of Serine Metabolism SHMT2, PC, ME2 KDM4E 3084/4885TP53 2252/4885CYP2D6 3232/4885
US-20030045483-A1 Novel substance having physiological activity, process for producing the same, and use UGGT1, IGFBP1, MGAM KDM4E 4645/4885TP53 4284/4885CYP2D6 2338/4885
US-20050143341-A1 Novel substance having physiological property, method for producing the same and uses thereof UGGT1, MGAM, IL6 KDM4E 4631/4885TP53 3685/4885CYP2D6 1469/4885
US-20190336583-A1 COMPOSITIONS AND METHODS FOR TREATING IRON OVERLOAD HAMP, FTH1, SLC40A1 KDM4E 4672/4885TP53 2331/4885CYP2D6 3006/4885

“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.