SCHEMBL4084570

SCHEMBL4084570

CN(C)CCNc1cc2c3c(cccc3c1)C(=O)NC2=O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
PKM P14618 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ATG4B Q9Y4P1 7/20 0.50
NPSR1 Q6W5P4 1/20 0.49
PARP1 P09874 1/20 0.47
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
PARG Q86W56 1/20 0.46
KLK7 P49862 1/20 0.44
BRD4 O60885 1/20 0.43
ATAD2 Q6PL18 1/20 0.43
MALT1 Q9UDY8 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
SCHEMBL11447330 0.93 MEN1 (0.49) MEN1KMT2APKMSMN1; SMN2ATG4B
SCHEMBL11440932 0.88 ATG4B (0.51) MEN1KMT2APKMSMN1; SMN2ATG4B
SCHEMBL11435038 0.83 ATG4B (0.49) MEN1KMT2APKMSMN1; SMN2ATG4B
SCHEMBL10340123 0.82 ATG4B (0.43) ATG4BKLK7BRD4ATAD2MALT1
Hydrochloric Acid SCHEMBL10340135 0.81 ATG4B (0.42) ATG4BKLK7BRD4ATAD2MALT1
SCHEMBL11435578 0.80 MEN1 (0.57) MEN1KMT2APKMSMN1; SMN2ATG4B
SCHEMBL11440845 0.77 NPSR1 (0.46) MEN1KMT2APKMSMN1; SMN2ATG4B
SCHEMBL9623183 0.76 KDM4E (0.48) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL11434865 0.76 NPSR1 (0.45) MEN1KMT2APKMSMN1; SMN2ATG4B
SCHEMBL11447415 0.76 MEN1 (0.45) MEN1KMT2APKMSMN1; SMN2ATG4B

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5183821-A Administering anticarcinogenic agents LABORATORIES KNOLL, S.A. (ES) 1993-02-02 US claimed
EP-1626050-B1 SULFUR-CONTAINING NAPHTHOYLIMIDE DERIVATIVES UNIV EAST CHINA SCIENCE & TECH (CN) 2009-12-02 EP disclosed
US-7541463-B2 Sulfur-containing naphthalimide derivatives EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2009-06-02 US disclosed
US-20080234287-A1 SULFUR-CONTAINING NAPHTHALIMIDE DERIVATIVES QIAN XUHONG 2008-09-25 US disclosed
US-20070117836-A1 NAPTHALIMIDE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS THEREFROM UNIBIOSCREEN S.A. (BE) 2007-05-24 US disclosed
EP-1787985-A1 Azonafide derivatives, methods for their production and pharmaceutical compositions therefrom Unibioscreen S.A. (BE) 2007-05-23 EP disclosed
EP-1742920-A2 NAPHTHALIMIDE DERIVATIVES FOR THE TREATMENT OF CANCER Unibioscreen S.A. (BE) 2007-01-17 EP disclosed
US-20060111367-A1 Sulfur-containing naphthalimide derivatives SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCE (CN) 2006-05-25 US disclosed
EP-1626050-A1 SULFUR-CONTAINING NAPHTHOYLIMIDE DERIVATIVES East China University of Science and Technology (CN) 2006-02-15 EP disclosed
WO-2005105753-A2 NAPHTHALIMIDE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS THEREFROM UNIBIOSCREEN S.A. (BE) 2005-11-10 WO disclosed
US-5183821-A Administering anticarcinogenic agents LABORATORIES KNOLL, S.A. (ES) 1993-02-02 US disclosed
US-5183821-A Administering anticarcinogenic agents LABORATORIES KNOLL, S.A. (ES) 1993-02-02 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 (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-20060111367-A1 Sulfur-containing naphthalimide derivatives HCCS, SQOR, MKI67 MEN1 3613/4885KMT2A 1942/4885PKM 2061/4885
US-20080234287-A1 SULFUR-CONTAINING NAPHTHALIMIDE DERIVATIVES HCCS, SQOR, MKI67 MEN1 3613/4885KMT2A 1942/4885PKM 2061/4885
US-20070117836-A1 NAPTHALIMIDE DERIVATIVES, METHODS FOR THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS THEREFROM NPM1, NAPRT, NUTF2 MEN1 2716/4885KMT2A 2924/4885PKM 418/4885

“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.