SCHEMBL4084709

SCHEMBL4084709

NNC(=O)CN1CCN(Cc2ccccc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.73
ATM Q13315 1/20 0.63
ALDH1A1 P00352 9/20 0.62
MEN1 O00255 3/20 0.62
KDM4E B2RXH2 1/20 0.62
GAA P10253 1/20 0.60
MAPT P10636 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
LMNA P02545 1/20 0.60
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA7 P43166 2/20 0.60
CA9 Q16790 1/20 0.59
SIGMAR1 Q99720 1/20 0.58

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
SCHEMBL20184188 0.95 KMT2A (0.68) KMT2AATMALDH1A1MEN1KDM4E
Cadaverine Tartrate SCHEMBL29125517 0.92 KMT2A (0.63) KMT2AATMALDH1A1MEN1KDM4E
SCHEMBL14860179 0.89 KMT2A (0.59) KMT2AATMALDH1A1MEN1KDM4E
SCHEMBL20381852 0.88 KMT2A (0.59) KMT2AATMALDH1A1MEN1KDM4E
SCHEMBL14859632 0.87 HRH3 (0.64) KMT2AALDH1A1MEN1KDM4EMAPT
SCHEMBL12222589 0.86 ALDH1A1 (0.56) KMT2AATMALDH1A1MEN1KDM4E
SCHEMBL14860115 0.86 SIGMAR1 (0.61) KMT2AATMALDH1A1MEN1KDM4E
SCHEMBL6863535 0.85 KMT2A (0.68) KMT2AATMALDH1A1MEN1KDM4E
SCHEMBL15372378 0.84 KMT2A (1.00) KMT2AALDH1A1MEN1MAPTLMNA
SCHEMBL14860509 0.84 KMT2A (0.63) KMT2AALDH1A1MEN1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117024378-A N' - [ (3-allyl-2-hydroxyphenyl) methylene ] -2- (4-benzyl-1-piperazinyl) acethydrazide tartrate crystal, and preparation method and application thereof 北京科佑爱科技有限责任公司 2023-11-10 CN claimed
CN-117024378-A N' - [ (3-allyl-2-hydroxyphenyl) methylene ] -2- (4-benzyl-1-piperazinyl) acethydrazide tartrate crystal, and preparation method and application thereof 北京科佑爱科技有限责任公司 2023-11-10 CN disclosed
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-9643960-B2 Procaspase activating compounds THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-05-09 US disclosed
US-9643960-B2 Procaspase activating compounds THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-05-09 US disclosed
US-20170105989-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-04-20 US disclosed
US-20170105989-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-04-20 US disclosed
US-20110257398-A1 Compositions and Methods Including Cell Death Inducers and Procaspase Activation THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2011-10-20 US disclosed
WO-2010091382-A1 DESIGN, SYNTHESIS AND EVALUATION OF PROCASPASE ACTIVATING COMPOUNDS AS PERSONALIZED ANTI-CANCER DRUGS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2010-08-12 WO disclosed
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
WO-2008134474-A2 COMPOSITIONS AND METHODS INCLUDING CELL DEATH INDUCERS AND PROCASPASE ACTIVATION THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2008-11-06 WO disclosed
US-20070049602-A1 Selective Apoptotic Induction in Cancer Cells Including Activation of Procaspase-3 THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-03-01 US disclosed
US-20070049602-A1 Selective Apoptotic Induction in Cancer Cells Including Activation of Procaspase-3 THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-03-01 US disclosed
EP-1692128-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2006-08-23 EP disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed
WO-2005051942-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2005-06-09 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 (8 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-20070049602-A1 Selective Apoptotic Induction in Cancer Cells Including Activation of Procaspase-3 CASP3, CASP7, CASP6 KMT2A 4674/4885ATM 953/4885ALDH1A1 2091/4885
US-20110257398-A1 Compositions and Methods Including Cell Death Inducers and Procaspase Activation CASP3, CASP6, CASP5 KMT2A 3246/4885ATM 2086/4885ALDH1A1 2167/4885
US-10166229-B2 Compounds and methods for the treatment of cancer CASP3, CASP6, CASP5 KMT2A 1515/4885ATM 1532/4885ALDH1A1 926/4885
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 KMT2A 4034/4885ATM 107/4885ALDH1A1 3165/4885
US-20190201394-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER CASP3, BAX, CASP6 KMT2A 3132/4885ATM 625/4885ALDH1A1 1106/4885
US-20170105989-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CANCER CASP3, CASP6, CASP5 KMT2A 1515/4885ATM 1532/4885ALDH1A1 926/4885
US-11612598-B2 Compounds and methods for the treatment of cancer CASP3, BAX, CASP6 KMT2A 3132/4885ATM 625/4885ALDH1A1 1106/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 KMT2A 4112/4885ATM 126/4885ALDH1A1 3055/4885

“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.