SCHEMBL1780673

SCHEMBL1780673

C1CCCC(NCCNC2C3CC4CC(C3)CC2C4)CCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 1/20 0.50
EPHX1 P07099 2/20 0.49
EPHX2 P34913 2/20 0.49
NPC1 O15118 1/20 0.49
KMT2A Q03164 1/20 0.49
RAD52 P43351 1/20 0.44
HSD11B1 P28845 4/20 0.42
DPP4 P27487 2/20 0.41
FAP Q12884 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
GGPS1 O95749 1/20 0.41
FDFT1 P37268 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CXCL12 P48061 1/20 0.36
CXCR4 P61073 1/20 0.36

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
SCHEMBL22163872 0.90 LMNA (0.52) LMNASMN1; SMN2ALDH1A1EPHX1EPHX2
SCHEMBL1778693 0.82 SMN1; SMN2 (0.61) LMNASMN1; SMN2ALDH1A1EPHX2GGPS1
SCHEMBL1779849 0.78 RAD52 (0.56) SMN1; SMN2ALDH1A1RAD52DPP4FAP
SCHEMBL455085 0.78 RAD52 (0.56) SMN1; SMN2ALDH1A1RAD52DPP4FAP
SCHEMBL3298507 0.75 RAD52 (0.52) SMN1; SMN2ALDH1A1RAD52DPP4FAP
SCHEMBL12344538 0.74 LMNA (0.48) LMNASMN1; SMN2ALDH1A1EPHX2GGPS1
SCHEMBL6444526 0.72 LMNA (0.47) LMNASMN1; SMN2ALDH1A1EPHX2GGPS1
SCHEMBL6444523 0.72 LMNA (0.52) LMNASMN1; SMN2ALDH1A1EPHX2GGPS1
SCHEMBL11522649 0.71 RAD52 (0.50) SMN1; SMN2ALDH1A1RAD52DPP7KDM4E
SCHEMBL4741840 0.71 RAD52 (0.50) SMN1; SMN2ALDH1A1RAD52DPP7KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513825-B1 ANTI TUBERCULAR DRUG: COMPOSITIONS AND METHODS Dept of Health and Human Services (US) 2016-10-05 EP disclosed
EP-1513825-B1 ANTI TUBERCULAR DRUG: COMPOSITIONS AND METHODS Dept of Health and Human Services (US) 2016-10-05 EP disclosed
US-8268894-B2 Compositions and methods for the treatment of infectious diseases THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2012-09-18 US disclosed
US-8268894-B2 Compositions and methods for the treatment of infectious diseases THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2012-09-18 US disclosed
US-8202910-B2 Compositions and methods for treatment of infectious disease SEQUELLA, INC. (US) 2012-06-19 US disclosed
US-8202910-B2 Compositions and methods for treatment of infectious disease SEQUELLA, INC. (US) 2012-06-19 US disclosed
US-8202910-B2 Compositions and methods for treatment of infectious disease SEQUELLA, INC. (US) 2012-06-19 US disclosed
US-20110118307-A1 Compositions and methods for the treatment of infectious diseases GOVERNMENT OF THE UNITED STATES OF AMERICA REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2011-05-19 US disclosed
US-20110118307-A1 Compositions and methods for the treatment of infectious diseases GOVERNMENT OF THE UNITED STATES OF AMERICA REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2011-05-19 US disclosed
US-7842729-B2 Anti tubercular drug: compositions and methods THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-11-30 US disclosed
US-7456222-B2 Anti tubercular drug: compositions and methods SEQUELLA, INC. (US) 2008-11-25 US disclosed
WO-2007005896-A2 ANTI-TUBERCULAR DRUGS: COMPOSITIONS AND METHODS SEQUELLA, INC. (US) 2007-01-11 WO disclosed
US-20060148904-A1 Anti tubercular drug: compositions and methods SEQUELLA, INC. 2006-07-06 US disclosed
US-20060020041-A1 Anti tubercular drug: compositions and methods SEQUELLA, INC. 2006-01-26 US disclosed
US-6951961-B2 Methods of use and compositions for the diagnosis and treatment of infectious disease GOVERNMENT OF THE UNITED STATES OF AMERICA REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2005-10-04 US disclosed
EP-1513825-A2 ANTI TUBERCULAR DRUG: COMPOSITIONS AND METHODS Department of Health and Human Services (US) 2005-03-16 EP disclosed
US-20040033986-A1 Anti tubercular drug: compositions and methods PROTOPOPOVA MARINA NIKOLAEVNA (US) 2004-02-19 US disclosed
US-20040019117-A1 Anti tubercular drug: compostions and methods PROTOPOPOVA MARINA NIKOLAEVNA (US) 2004-01-29 US disclosed
US-20030236225-A1 Methods of use and compositions for the diagnosis and treatment of infectious disease GOVERNMENT OF THE UNITED STATES OF AMERICA REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2003-12-25 US disclosed
WO-2003096989-A2 ANTI TUBERCULAR DRUG: COMPOSITIONS AND METHODS DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2003-11-27 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 (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-20110118307-A1 Compositions and methods for the treatment of infectious diseases TERT, C5, ELANE LMNA 940/4885SMN1; SMN2 665/4885ALDH1A1 1876/4885
US-20030236225-A1 Methods of use and compositions for the diagnosis and treatment of infectious disease TERT, C5, DERA LMNA 1394/4885SMN1; SMN2 1018/4885ALDH1A1 1103/4885
US-20060148904-A1 Anti tubercular drug: compositions and methods C5, DERA, ELL LMNA 1085/4885SMN1; SMN2 2565/4885ALDH1A1 1277/4885
US-20060020041-A1 Anti tubercular drug: compositions and methods C5, DERA, ELL LMNA 1085/4885SMN1; SMN2 2565/4885ALDH1A1 1277/4885
US-20040033986-A1 Anti tubercular drug: compositions and methods C5, DERA, ELL LMNA 1085/4885SMN1; SMN2 2565/4885ALDH1A1 1277/4885
US-20040019117-A1 Anti tubercular drug: compostions and methods TYMS, TERT, TYMP LMNA 1290/4885SMN1; SMN2 2656/4885ALDH1A1 1691/4885

“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.