SCHEMBL1778423

SCHEMBL1778423

COC(=O)N1CCC[C@H]1C

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
GAA P10253 2/20 0.46
HPGD P15428 2/20 0.46
ALDH1A1 P00352 3/20 0.42
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
EPHX2 P34913 1/20 0.38
POLB P06746 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 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
SCHEMBL2681321 1.00 TSHR (0.57) TSHRGAAHPGDALDH1A1MAPT
SCHEMBL10202112 1.00 TSHR (0.57) TSHRGAAHPGDALDH1A1MAPT
Hydrochloric Acid SCHEMBL2057759 0.98 TSHR (0.55) TSHRGAAHPGDALDH1A1MAPT
SCHEMBL771163 0.94 TSHR (0.55) TSHRGAAHPGDALDH1A1MAPT
Hydrochloric Acid SCHEMBL2526142 0.92 TSHR (0.53) TSHRGAAHPGDALDH1A1MAPT
Acetic Acid SCHEMBL30499237 0.89 TSHR (0.50) TSHRGAAHPGDALDH1A1MAPT
SCHEMBL1631699 0.87
SCHEMBL23064563 0.83 HPGD (0.46) TSHRGAAHPGDALDH1A1KMT2A
SCHEMBL16741962 0.83 HPGD (0.46) TSHRGAAHPGDALDH1A1KMT2A
SCHEMBL20880161 0.81 HPGD (0.41) TSHRGAAHPGDALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1665801-B Anti tubercular drug: compositions and methods DEPT OF HEALTH AND HUMAN SERVI 2011-05-11 CN claimed
WO-2021009768-A1 AN ORAL PHARMACEUTICAL COMPOSITION FOR ALPHA- AMYLASE INHIBITION LOVELY PROFESSIONAL UNIVERSITY (IN) 2021-01-21 WO disclosed
EP-2635571-B1 NOVEL INHIBITORS OF HEPATITIS C VIRUS THERAVANCE BIOPHARMA R & D IP LLC (US) 2015-08-12 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-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
CN-1665801-B Anti tubercular drug: compositions and methods DEPT OF HEALTH AND HUMAN SERVI 2011-05-11 CN 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
CN-101636376-A Antituberculous drugs: compositions and methods SEQUELLA INC 2010-01-27 CN disclosed
US-20090192173-A1 ANTI-TUBERCULAR DRUGS: COMPOSITIONS AND METHODS SEQUELLA, INC. 2009-07-30 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
US-6639076-B1 Such as 2-(2-amino-2-methylpropanoylamino)-n-(1-(2-oxo-1-phenyl-2-pyrrolidinylethyl -4-yl)-4-phenylbutanamide ELI LILLY AND COMPANY 2003-10-28 US disclosed
EP-1112071-A4 GROWTH HORMONE SECRETAGOGUES LILLY CO ELI (US) 2003-03-19 EP disclosed
US-6329342-B1 CARDIOVASCULAR DISORDERS ELI LILLY AND COMPANY 2001-12-11 US disclosed
EP-1112071-A1 GROWTH HORMONE SECRETAGOGUES Eli Lilly & Company (US) 2001-07-04 EP disclosed
CN-1276727-A Growth hormone secretagogues LILLY CO ELI (US) 2000-12-13 CN disclosed
WO-2000010565-A1 GROWTH HORMONE SECRETAGOGUES ELI LILLY AND COMPANY (US) 2000-03-02 WO disclosed
WO-1999008697-A1 TREATMENT OF CONGESTIVE HEART FAILURE WITH GROWTH HORMONE SECRETAGOGUES ELI LILLY AND COMPANY (US) 1999-02-25 WO disclosed
WO-1999008699-A1 GROWTH HORMONE SECRETAGOGUES ELI LILLY AND COMPANY (US) 1999-02-25 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 (3 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 TSHR 2407/4885GAA 166/4885HPGD 890/4885
US-20090192173-A1 ANTI-TUBERCULAR DRUGS: COMPOSITIONS AND METHODS RIF1, TERT, ELL TSHR 2423/4885GAA 499/4885HPGD 352/4885
US-20030236225-A1 Methods of use and compositions for the diagnosis and treatment of infectious disease TERT, C5, DERA TSHR 1870/4885GAA 506/4885HPGD 733/4885

“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.