SCHEMBL1362510

SCHEMBL1362510

O=C1OC2(c3ccc(O)cc3Oc3cc(O)ccc32)c2cccc(N[C]=S)c21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 10/20 0.55
MAPT P10636 3/20 0.55
HPGD P15428 2/20 0.55
MEN1 O00255 2/20 0.55
HTT P42858 2/20 0.55
KMT2A Q03164 2/20 0.55
SMAD3 P84022 2/20 0.55
CYP2C19 P33261 1/20 0.55
RECQL P46063 1/20 0.55
BLM P54132 1/20 0.55
PRMT1 Q99873 1/20 0.55
ACE2 Q9BYF1 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
ALOX12 P18054 2/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP2C9 P11712 1/20 0.53
ALOX15 P16050 1/20 0.53
BRCA1 P38398 1/20 0.53
HSD17B10 Q99714 1/20 0.53
LMNA P02545 2/20 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
SCHEMBL9428563 0.89 FTO (0.56) FTOMAPTHPGDMEN1HTT
SCHEMBL9280412 0.84 FTO (0.59) FTOMAPTHPGDMEN1HTT
SCHEMBL22334359 0.83 FTO (0.54) FTOMAPTHPGDMEN1HTT
SCHEMBL15759875 0.83 FTO (0.54) FTOMAPTHPGDMEN1HTT
SCHEMBL9427763 0.83 FTO (0.54) FTOMAPTHPGDMEN1HTT
SCHEMBL9428188 0.82 FTO (0.56) FTOMAPTHPGDMEN1HTT
SCHEMBL2933847 0.82 FTO (0.53) FTOMAPTHPGDMEN1HTT
SCHEMBL5149281 0.81 FTO (0.55) FTOMAPTHPGDMEN1HTT
SCHEMBL9427469 0.81 HPGD (0.56) FTOMAPTHPGDMEN1HTT
SCHEMBL1254421 0.81 FTO (0.64) FTOMAPTHPGDMEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0606804-B1 Marker for neurotensin receptor MARTINEX R & D INC (CA) 2001-10-04 EP claimed
EP-0069450-B1 LABELLED VITAMIN B12 DERIVATIVES, THEIR PREPARATION AND USE TECHNICON INSTRUMENTS CORPORATION (a New York corporation) (US) 1985-04-10 EP claimed
US-11604185-B2 Methods for detection of botulinum neurotoxin CITY OF HOPE (US) 2023-03-14 US disclosed
US-20210255174-A1 METHODS FOR DETECTION OF BOTULINUM NEUROTOXIN CITY OF HOPE (US) 2021-08-19 US disclosed
US-10775366-B2 Substrates for detection of botulinum neurotoxin CITY OF HOPE (US) 2020-09-15 US disclosed
US-20170153228-A1 METHODS FOR DETECTION OF BOTULINUM NEUROTOXIN NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-06-01 US disclosed
US-9562903-B2 Methods for detection of botulinum neurotoxin CITY OF HOPE (US) 2017-02-07 US disclosed
US-20140287433-A1 MEANS AND METHODS FOR DETERMINING CLOSTRIDIAL NEUROTOXINS ETH Zürich (CH) 2014-09-25 US disclosed
US-20140235490-A1 METHODS FOR DETECTION OF BOTULINUM NEUROTOXIN CITY OF HOPE (US) 2014-08-21 US disclosed
US-8753831-B2 Methods for detection of botulinum neurotoxin CITY OF HOPE (US) 2014-06-17 US disclosed
EP-2734635-A1 MEANS AND METHODS FOR DETERMINING CLOSTRIDIAL NEUROTOXINS ETH Zürich (CH) 2014-05-28 EP disclosed
US-8067192-B2 Methods for detection of botulinum neurotoxin CITY OF HOPE (US) 2011-11-29 US disclosed
US-20100298390-A1 INHIBITION OF LETHAL FACTOR PROTEASE ACTIVITY FROM ANTHRAX TOXIN BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-11-25 US disclosed
US-7718680-B2 Inhibition of lethal factor protease activity from anthrax toxin BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-05-18 US disclosed
US-20090176259-A1 METHODS FOR DETECTION OF BOTULINUM NEUROTOXIN NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-07-09 US disclosed
US-20090082266-A1 CONJUGATE OF WATER-SOLUBLE HYALURONIC ACID MODIFICATION PRODUCT WITH GLP-A ANALOGUE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-03-26 US disclosed
US-20080033025-A1 Inhibition of lethal factor protease activity from anthrax toxin NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2008-02-07 US disclosed
EP-1857467-A1 CONJUGATE OF WATER-SOLUBLE MODIFIED HYALURONIC ACID AND GLP-1 ANALOGUE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-11-21 EP disclosed
US-6630295-B2 Monitoring molecular weight adjustment in ionic compound; obtain chemical intermediates, incubate with fluorescent dyes, monitor fluorescence polarization to detect molecular weight adjustment INSIGHT STRATEGY & MARKETING LTD. (IL) 2003-10-07 US disclosed
US-20020115071-A1 High throughput assay for monitoring polycation or polyanion molecular weight, degradation or synthesis INSIGHT STRATEGY & MARKETING LTD. 2002-08-22 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 (6 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-11604185-B2 Methods for detection of botulinum neurotoxin ANTXR2, INHA, PRSS12 FTO 3566/4885MAPT 3282/4885HPGD 2615/4885
US-20090082266-A1 CONJUGATE OF WATER-SOLUBLE HYALURONIC ACID MODIFICATION PRODUCT WITH GLP-A ANALOGUE GLP1R, IAPP, GIPR FTO 1132/4885MAPT 3502/4885HPGD 418/4885
US-20210255174-A1 METHODS FOR DETECTION OF BOTULINUM NEUROTOXIN ANTXR2, INHA, PRSS12 FTO 3566/4885MAPT 3282/4885HPGD 2615/4885
US-10775366-B2 Substrates for detection of botulinum neurotoxin ANTXR2, INHA, PRSS12 FTO 3330/4885MAPT 3233/4885HPGD 2573/4885
US-20100298390-A1 INHIBITION OF LETHAL FACTOR PROTEASE ACTIVITY FROM ANTHRAX TOXIN APAF1, ANTXR2, SERPINB1 FTO 4851/4885MAPT 4512/4885HPGD 1670/4885
US-20080033025-A1 Inhibition of lethal factor protease activity from anthrax toxin APAF1, ANTXR2, SERPINB1 FTO 4851/4885MAPT 4512/4885HPGD 1670/4885

“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.