SCHEMBL4083554

SCHEMBL4083554

CCOC(=O)CN1CCN(Cc2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
ALDH1A1 P00352 4/20 0.59
SIGMAR1 Q99720 1/20 0.55
TSHR P16473 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
POLB P06746 1/20 0.54
MAPK1 P28482 2/20 0.54
PKM P14618 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53

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
SCHEMBL9643788 1.00 LMNA (0.60) LMNAALDH1A1SIGMAR1TSHRMEN1
SCHEMBL6707334 0.89 SMN1; SMN2 (0.56) LMNAALDH1A1TSHRKMT2A
SCHEMBL14859966 0.89 NPC1 (0.67) LMNAALDH1A1MEN1KMT2AMAPK1
SCHEMBL10330737 0.89 SMN1; SMN2 (0.56) LMNAALDH1A1TSHRKMT2A
SCHEMBL12222591 0.88 ALDH1A1 (0.58) LMNAALDH1A1MEN1KMT2APOLB
SCHEMBL7549710 0.87 DRD4 (0.56) LMNAALDH1A1SIGMAR1MEN1KMT2A
SCHEMBL14860601 0.86 KDM4E (0.58) LMNAALDH1A1SIGMAR1TSHRMEN1
SCHEMBL14859627 0.86 CCR8 (0.69) LMNAALDH1A1MEN1KMT2A
SCHEMBL9217160 0.86 LMNA (0.48) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL18466544 0.86 LMNA (0.50) LMNAALDH1A1MEN1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1072661-C Novel substituted [2-(1-piperazinyl) ethoxy] methyl UCB SA (BE) 2001-10-10 CN claimed
CN-1215395-A Novel substituted [2-(1-piperazinyl) ethoxy] methyl UCB SA (BE) 1999-04-28 CN claimed
US-11612598-B2 Compounds and methods for the treatment of cancer THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2023-03-28 US disclosed
EP-1893210-B1 SELECTIVE APOPTOTIC INDUCTION IN CANCER CELLS INCLUDING ACTIVATION OF PROCASPASE-3 UNIV ILLINOIS (US) 2019-10-02 EP disclosed
US-20190201394-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2019-07-04 US disclosed
US-10166229-B2 Compounds and methods for the treatment of cancer THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2019-01-01 US disclosed
US-20180360824-A1 PROCASPASE-ACTIVATING COMPOUNDS AND METHODS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2018-12-20 US disclosed
EP-2880020-B1 ENZYME-ACTIVATING COMPOUNDS AND COMPOSITIONS UNIV ILLINOIS (US) 2018-11-28 EP disclosed
US-10022371-B2 Procaspase-activating compounds and methods THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2018-07-17 US disclosed
US-9663482-B2 Substituted piperazinyl acetohydrazide procaspase-activating compounds THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-05-30 US disclosed
US-9643960-B2 Procaspase activating compounds THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-05-09 US disclosed
CN-1391473-A VLA-4 inhibitor compounds DAIICHI SEIYAKU CO (JP) 2003-01-15 CN disclosed
EP-1189612-A1 VLA-4 INHIBITOR COMPOUNDS Daiichi Pharmaceutical Co., Ltd. (JP) 2002-03-27 EP disclosed
US-6352993-B1 ANTIULCER AGENTS YUHAN CORPORATION (KR) 2002-03-05 US disclosed
CN-1072661-C Novel substituted [2-(1-piperazinyl) ethoxy] methyl UCB SA (BE) 2001-10-10 CN disclosed
WO-2001000206-A1 VLA-4 INHIBITOR COMPOUNDS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-01-04 WO disclosed
EP-1015444-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION, LTD. (KR) 2000-07-05 EP disclosed
CN-1215395-A Novel substituted [2-(1-piperazinyl) ethoxy] methyl UCB SA (BE) 1999-04-28 CN disclosed
WO-1998043968-A1 NOVEL PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 1998-10-08 WO disclosed
US-5519023-A SCHIZOPHRENIA ADIR ET COMPAGNIE (FR) 1996-05-21 US 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-10166229-B2 Compounds and methods for the treatment of cancer CASP3, CASP6, CASP5 LMNA 337/4885ALDH1A1 926/4885SIGMAR1 3958/4885
US-20180360824-A1 PROCASPASE-ACTIVATING COMPOUNDS AND METHODS CASP3, CASP5, CASP6 LMNA 294/4885ALDH1A1 3075/4885SIGMAR1 4613/4885
US-20190201394-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER CASP3, BAX, CASP6 LMNA 282/4885ALDH1A1 1106/4885SIGMAR1 4213/4885
US-11612598-B2 Compounds and methods for the treatment of cancer CASP3, BAX, CASP6 LMNA 282/4885ALDH1A1 1106/4885SIGMAR1 4213/4885
US-10022371-B2 Procaspase-activating compounds and methods CASP3, CASP5, CASP6 LMNA 294/4885ALDH1A1 3075/4885SIGMAR1 4613/4885

“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.