SCHEMBL4400710

SCHEMBL4400710

CC[C@H](C)[C@H](N)C(=O)OC(=O)[C@@H](N)Cc1c[nH]c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.58
MAPT P10636 2/20 0.58
MEN1 O00255 1/20 0.58
LMNA P02545 1/20 0.58
MPO P05164 1/20 0.58
TSHR P16473 1/20 0.58
BLM P54132 1/20 0.58
PMP22 Q01453 1/20 0.58
KMT2A Q03164 1/20 0.58
HIF1A Q16665 1/20 0.58
TACR1 P25103 2/20 0.57
HTR2A P28223 2/20 0.54
ADRB1 P08588 1/20 0.53
HTR1A P08908 1/20 0.53
ADRA2A P08913 1/20 0.53
SLC6A2 P23975 1/20 0.53
HTR1D P28221 1/20 0.53
HTR1B P28222 1/20 0.53
HTR2C P28335 1/20 0.53
HTR1E P28566 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
SCHEMBL4852920 0.90 KDM4E (0.62) KDM4EMAPTMEN1LMNAMPO
SCHEMBL28548565 0.88 KDM4E (0.61) KDM4EMAPTMEN1LMNAMPO
SCHEMBL10527492 0.88 KDM4E (0.61) KDM4EMAPTMEN1LMNAMPO
SCHEMBL5481926 0.88 KDM4E (0.61) KDM4EMAPTMEN1LMNAMPO
SCHEMBL475351 0.88 MAPT (0.74) KDM4EMAPTMEN1LMNAMPO
SCHEMBL289044 0.88 MAPT (0.74) KDM4EMAPTMEN1LMNAMPO
SCHEMBL5065255 0.87 KDM4E (0.65) KDM4EMAPTMEN1LMNAMPO
SCHEMBL3857025 0.87 KDM4E (0.52) KDM4EMAPTMEN1LMNAMPO
SCHEMBL4335856 0.85 KDM4E (0.62) KDM4EMAPTMEN1LMNAMPO
SCHEMBL29701310 0.84 KDM4E (0.58) KDM4EMAPTMEN1LMNAMPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105134-A1 C-Terminally Pegylated Growth Hormones NOVO NORDISK A/S (DK) 2009-04-23 US claimed
US-20030104389-A1 Synthesis of biologically active compounds in cells SERGEEV PAVEL (CH) 2003-06-05 US claimed
EP-1208219-A1 SYNTHESIS OF BIOLOGICALLY ACTIVE COMPOUNDS IN CELLS Sergeev, Pavel (CH) 2002-05-29 EP claimed
WO-2000061775-A1 SYNTHESIS OF BIOLOGICALLY ACTIVE COMPOUNDS IN CELLS SERGEEV PAVEL (CH) 2000-10-19 WO claimed
CN-111386050-B Morbidity risk assessment device, morbidity risk assessment method, and computer-readable medium 国立大学法人九州大学 2024-02-06 CN disclosed
CN-113397056-A Feed for improving lean meat percentage of piglets and preparation method and application thereof 长春禾丰饲料有限责任公司 2021-09-17 CN disclosed
CN-111386050-A Disease risk evaluation device, disease risk evaluation method, program, and dementia prevention food 国立大学法人九州大学 2020-07-07 CN disclosed
US-8795734-B2 Hydrophobic nanotubes and nanoparticles as transporters for the delivery of drugs into cells THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2014-08-05 US disclosed
US-20130034610-A1 HYDROPHOBIC NANOTUBES AND NANOPARTICLES AS TRANSPORTERS FOR THE DELIVERY OF DRUGS INTO CELLS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2013-02-07 US disclosed
US-8246995-B2 Hydrophobic nanotubes and nanoparticles as transporters for the delivery of drugs into cells THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2012-08-21 US disclosed
US-7459443-B2 Oligonucleotide sequences for use as viricide or antitumor agents; biosynthesis SERGEEV PAVEL 2008-12-02 US disclosed
US-20060275371-A1 Hydrophobic nanotubes and nanoparticles as transporters for the delivery of drugs into cells UNIVERSITY, STANFORD 2006-12-07 US disclosed
US-20050026143-A1 Synthesis of biologically active compounds in cells SERGEEV PAVEL (CH) 2005-02-03 US disclosed
US-6831071-B2 Oligonucleotide sequences for use as viricide or antitumor agents SERGEEV PAVEL (CH) 2004-12-14 US disclosed
WO-2004080920-A1 HYDROPONIC PLANT NUTRIENT KIT AND METHOD OF USE ADVANCED NUTRIENTS LTD. (CA) 2004-09-23 WO disclosed
US-20030104389-A1 Synthesis of biologically active compounds in cells SERGEEV PAVEL (CH) 2003-06-05 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 (2 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-20090105134-A1 C-Terminally Pegylated Growth Hormones GHRHR, GHITM, HDGF KDM4E 4141/4885MAPT 3647/4885MEN1 225/4885
US-20050026143-A1 Synthesis of biologically active compounds in cells FBL, RNGTT, NOP2 KDM4E 4491/4885MAPT 4003/4885MEN1 1270/4885

“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.