SCHEMBL1778693

SCHEMBL1778693

C(CNC1C2CC3CC(C2)CC1C3)NC1C2CC3CC(C2)CC1C3

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.61
LMNA P02545 2/20 0.61
ALDH1A1 P00352 2/20 0.53
FDFT1 P37268 2/20 0.46
GGPS1 O95749 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.46
TDP1 Q9NUW8 2/20 0.46
EPHX2 P34913 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41

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
SCHEMBL6444523 0.88 LMNA (0.52) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
SCHEMBL22163872 0.88 LMNA (0.52) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
SCHEMBL1073954 0.85 LMNA (0.48) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
SCHEMBL12344538 0.85 LMNA (0.48) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
SCHEMBL14573044 0.85 EPHX2 (0.53) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
SCHEMBL5385637 0.85 LMNA (0.48) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
SCHEMBL8968921 0.85 ALDH1A1 (0.51) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
Hydrochloric Acid SCHEMBL1073730 0.83 SMN1; SMN2 (0.52) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
SCHEMBL6444526 0.83 LMNA (0.47) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1
SCHEMBL1780673 0.82 LMNA (0.51) SMN1; SMN2LMNAALDH1A1FDFT1GGPS1

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 26 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
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-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
EP-1909780-A2 ANTI-TUBERCULAR DRUGS: COMPOSITIONS AND METHODS Sequella, Inc. (US) 2008-04-16 EP disclosed
WO-2007005896-A2 ANTI-TUBERCULAR DRUGS: COMPOSITIONS AND METHODS SEQUELLA, INC. (US) 2007-01-11 WO 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
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
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 (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-20110118307-A1 Compositions and methods for the treatment of infectious diseases TERT, C5, ELANE SMN1; SMN2 665/4885LMNA 940/4885ALDH1A1 1876/4885
US-20060148904-A1 Anti tubercular drug: compositions and methods C5, DERA, ELL SMN1; SMN2 2565/4885LMNA 1085/4885ALDH1A1 1277/4885
US-20060020041-A1 Anti tubercular drug: compositions and methods C5, DERA, ELL SMN1; SMN2 2565/4885LMNA 1085/4885ALDH1A1 1277/4885
US-20040033986-A1 Anti tubercular drug: compositions and methods C5, DERA, ELL SMN1; SMN2 2565/4885LMNA 1085/4885ALDH1A1 1277/4885
US-20040019117-A1 Anti tubercular drug: compostions and methods TYMS, TERT, TYMP SMN1; SMN2 2656/4885LMNA 1290/4885ALDH1A1 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.