SCHEMBL1275151

SCHEMBL1275151

c1cnc(Sc2cncnc2)nc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
MITF O75030 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
CYP2A6 P11509 1/20 0.33
HSP90AA1 P07900 1/20 0.32
ATM Q13315 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
HSD17B10 Q99714 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL16056837 0.77 CYP2A6 (0.43) KDM4EMAPTHTTCYP2A6HSP90AA1
SCHEMBL4135470 0.73 HSD17B10 (0.40) KDM4EMITFMAPTHTTHSP90AA1
SCHEMBL2129184 0.70 HSD17B10 (0.46) KDM4EMAPTHTTHSD17B10SMN1; SMN2
SCHEMBL16056949 0.68 ATM (0.48) MAPTHTTATMHSD17B10SMN1; SMN2
SCHEMBL10396004 0.67 CYP3A4 (0.59) KDM4EMAPTHSP90AA1NPC1RAB9A
SCHEMBL8363005 0.65 NPC1 (0.60) KDM4EMAPTHTTNPC1RAB9A
SCHEMBL10394650 0.65 L3MBTL1 (0.62) KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL20379640 0.65 TSHR (0.64) KDM4EMAPTHTTSMN1; SMN2
SCHEMBL29038792 0.63 HSP90AA1 (0.60) KDM4EMAPTHTTCYP2A6HSP90AA1
SCHEMBL10975798 0.63 HTT (0.33) KDM4EMITFMAPTHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9797883-B2 Re-trafficking of herg reverses long QT syndrome 2 phenotype in human iPS-derived cardiomyocytes SINGAPORE HEALTH SERVICES PTE LTD (SG) 2017-10-24 US claimed
EP-2972323-B1 RE-TRAFFICKING OF HERG REVERSES LONG QT SYNDROME 2 PHENOTYPE IN HUMAN IPS-DERIVED CARDIOMYOCYTES SINGAPORE HEALTH SERV PTE LTD (SG) 2017-09-13 EP claimed
US-20160033481-A1 RE-TRAFFICKING OF HERG REVERSES LONG QT SYNDROME 2 PHENOTYPE IN HUMAN IPS-DERIVED CARDIOMYOCYTES SINGAPORE HEALTH SERVICES PTE LTD (SG) 2016-02-04 US claimed
EP-2972323-A2 RE-TRAFFICKING OF HERG REVERSES LONG QT SYNDROME 2 PHENOTYPE IN HUMAN IPS-DERIVED CARDIOMYOCYTES Singapore Health Services Pte Ltd (SG) 2016-01-20 EP claimed
WO-2014142760-A2 RE-TRAFFICKING OF HERG REVERSES LONG QT SYNDROME 2 PHENOTYPE IN HUMAN IPS-DERIVED CARDIOMYOCYTES SINGAPORE HEALTH SERVICES PTE LTD (SG) 2014-09-18 WO claimed
US-12590966-B2 Method for treating cancer THE CHILDREN'S MEDICAL CENTER CORPORATION 2026-03-31 US disclosed
US-20230149295-A1 INFLAMMATORY BOWEL DISEASE STEM CELLS, AGENTS WHICH TARGET IBD STEM CELLS, AND USES RELATED THERETO UNIVERSITY OF HOUSTON SYSTEM (US) 2023-05-18 US disclosed
EP-4121111-A1 METHODS AND COMPOSITIONS FOR TREATING INFLAMMATORY AND FIBROTIC PULMONARY DISORDERS University of Houston System (US) 2023-01-25 EP disclosed
EP-4117718-A1 INFLAMMATORY BOWEL DISEASE STEM CELLS, AGENTS WHICH TARGET IBD STEM CELLS, AND USES RELATED THERETO University of Houston System (US) 2023-01-18 EP disclosed
US-20230003732-A1 METHOD FOR TREATING CANCER THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-01-05 US disclosed
EP-3359196-B1 RATIONAL COMBINATION THERAPY FOR THE TREATMENT OF CANCER MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2022-03-16 EP disclosed
US-20210401987-A1 METHODS AND COMPOSITIONS FOR TREATING INFLAMMATORY AND FIBROTIC PULMONARY DISORDERS UNIVERSITY OF HOUSTON SYSTEM (US) 2021-12-30 US disclosed
EP-2467142-B1 2-(Pyrimidin-5-yl)-thiopyrimidine derivatives as Hsp70 and Hsc70 modulators for the treatment of proliferative disorders SLOAN KETTERING INST CANCER (US) 2016-09-21 EP disclosed
EP-2467142-B1 2-(Pyrimidin-5-yl)-thiopyrimidine derivatives as Hsp70 and Hsc70 modulators for the treatment of proliferative disorders SLOAN KETTERING INST CANCER (US) 2016-09-21 EP disclosed
US-20160033481-A1 RE-TRAFFICKING OF HERG REVERSES LONG QT SYNDROME 2 PHENOTYPE IN HUMAN IPS-DERIVED CARDIOMYOCYTES SINGAPORE HEALTH SERVICES PTE LTD (SG) 2016-02-04 US disclosed
EP-2972323-A2 RE-TRAFFICKING OF HERG REVERSES LONG QT SYNDROME 2 PHENOTYPE IN HUMAN IPS-DERIVED CARDIOMYOCYTES Singapore Health Services Pte Ltd (SG) 2016-01-20 EP disclosed
WO-2014142760-A2 RE-TRAFFICKING OF HERG REVERSES LONG QT SYNDROME 2 PHENOTYPE IN HUMAN IPS-DERIVED CARDIOMYOCYTES SINGAPORE HEALTH SERVICES PTE LTD (SG) 2014-09-18 WO disclosed
US-20120252818-A1 HEAT SHOCK PROTEIN BINDING COMPOUNDS, COMPOSITIONS, AND METHODS FOR MAKING AND USING SAME MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2012-10-04 US disclosed
EP-2467142-A2 HEAT SHOCK PROTEIN BINDING COMPOUNDS, COMPOSITIONS, AND METHODS FOR MAKING AND USING SAME Memorial Sloan-Kettering Cancer Center (US) 2012-06-27 EP disclosed
WO-2011022440-A2 HEAT SHOCK PROTEIN BINDING COMPOUNDS, COMPOSITIONS, AND METHODS FOR MAKING AND USING SAME MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2011-02-24 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 (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-20210401987-A1 METHODS AND COMPOSITIONS FOR TREATING INFLAMMATORY AND FIBROTIC PULMONARY DISORDERS MMP1, MMP8, CCL11 KDM4E 3729/4885MITF 4209/4885MAPT 3332/4885
US-20230003732-A1 METHOD FOR TREATING CANCER GSK3A, GSK3B, GSKIP KDM4E 3029/4885MITF 4045/4885MAPT 1728/4885
US-20120252818-A1 HEAT SHOCK PROTEIN BINDING COMPOUNDS, COMPOSITIONS, AND METHODS FOR MAKING AND USING SAME HSPBP1, HSF1, HSPA2 KDM4E 3776/4885MITF 2126/4885MAPT 606/4885
US-20230149295-A1 INFLAMMATORY BOWEL DISEASE STEM CELLS, AGENTS WHICH TARGET IBD STEM CELLS, AND USES RELATED THERETO EPCAM, FABP2, TPMT KDM4E 448/4885MITF 1936/4885MAPT 4173/4885
US-12590966-B2 Method for treating cancer GSK3B, GSK3A, GSKIP KDM4E 3160/4885MITF 4036/4885MAPT 1305/4885

“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.