SCHEMBL433102

SCHEMBL433102

O=C(O)CCSc1ccccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 1.00
KMT2A Q03164 2/20 0.73
MAPT P10636 1/20 0.73
HPGD P15428 4/20 0.61
NPC1 O15118 6/20 0.57
RAB9A P51151 6/20 0.57
SMN1; SMN2 Q16637 5/20 0.57
PRNP P04156 1/20 0.55
MAPK10 P53779 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
POLB P06746 2/20 0.54
MEN1 O00255 1/20 0.51
PKM P14618 1/20 0.51
CDC25B P30305 1/20 0.50
LMNA P02545 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
HSD17B10 Q99714 2/20 0.49

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
SCHEMBL30602595 1.00 ALDH1A1 (1.00) ALDH1A1KMT2AMAPTHPGDNPC1
SCHEMBL16564081 0.90 ALDH1A1 (0.81) ALDH1A1KMT2AMAPTHPGDNPC1
SCHEMBL2678377 0.88 ALDH1A1 (0.79) ALDH1A1KMT2AMAPTHPGDNPC1
SCHEMBL8916154 0.87 ALDH1A1 (0.77) ALDH1A1KMT2AMAPTHPGDNPC1
SCHEMBL21768397 0.86 ALDH1A1 (0.74) ALDH1A1KMT2AMAPTHPGDNPC1
SCHEMBL20202251 0.84 ALDH1A1 (0.72) ALDH1A1KMT2AMAPTHPGDNPC1
SCHEMBL98030 0.84 ALDH1A1 (0.73) ALDH1A1KMT2AMAPTHPGDNPC1
SCHEMBL4055817 0.84 ALDH1A1 (0.73) ALDH1A1KMT2AMAPTHPGDNPC1
SCHEMBL29811281 0.84 ALDH1A1 (0.73) ALDH1A1KMT2AMAPTHPGDNPC1
Succinic Acid SCHEMBL28529727 0.83 ALDH1A1 (0.71) ALDH1A1KMT2AMAPTHPGDNPC1

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
US-20100003701-A1 COVALENT MODIFICATION AND CONJUGATION OF LUCIFERASE CARDIOGENICS INC. (CA) 2010-01-07 US claimed
US-20070254311-A1 Covalent modification and conjugation of luciferase CARDIOGENICS INC. (CA) 2007-11-01 US claimed
EP-0184701-B1 A method for determining a ligand HOECHST CELANESE CORP (US) 1994-06-08 EP claimed
EP-0440647-A1 LABELED NUCLEIC ACID PROBE BIOGEN, INC. (US) 1991-08-14 EP claimed
WO-1990007924-A1 PROTEIN COUPLING TO LIPID VESICLES MICRO VESICULAR SYSTEMS, INC. (US) 1990-07-26 WO claimed
WO-1989012110-A1 LABELED NUCLEIC ACID PROBE BIOGEN, INC. (US) 1989-12-14 WO claimed
EP-3473249-A1 CROSSLINKABLE DENDRIMERS Wayne State University (US) 2019-04-24 EP disclosed
US-20170028075-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES Ashvattha Therapeutics, Inc. 2017-02-02 US disclosed
US-9526794-B2 Injectable dendrimer hydrogel nanoparticles WAYNE STATE UNIVERSITY (US) 2016-12-27 US disclosed
CN-106103731-A Compositions and methods for providing active telomerase to cells in vivo 特洛雷根公司 2016-11-09 CN disclosed
US-20130136697-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES NATIONAL INSTITUTES OF HEALTH (US) 2013-05-30 US disclosed
EP-2595957-A1 PYRIDIN- 2 - YL SULFANYL ACID ESTERS AND PROCESS FOR THE PREPARATION THEREOF Council of Scientific & Industrial Research (IN) 2013-05-29 EP disclosed
EP-2552458-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES Wayne State University (US) 2013-02-06 EP disclosed
EP-0440647-A1 LABELED NUCLEIC ACID PROBE BIOGEN, INC. (US) 1991-08-14 EP disclosed
EP-0350315-A1 Rhizoxin derivates and their use as anti-tumor agents SANKYO COMPANY LIMITED (JP) 1990-01-10 EP disclosed
WO-1989012110-A1 LABELED NUCLEIC ACID PROBE BIOGEN, INC. (US) 1989-12-14 WO disclosed
US-4876190-A MEDICAL DIAGNOSIS, IMMUNOASSAY BECTON DICKINSON & COMPANY (US) 1989-10-24 US disclosed
EP-0314406-A1 Peridinin-chlorophyll complex as fluorescent label Becton, Dickinson and Company (US) 1989-05-03 EP disclosed
US-4565696-A ADMINISTERING TO PRODUCE ANTIBODIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1986-01-21 US disclosed
US-4542104-A Phycobiliprotein fluorescent conjugates THE BOARD OF TRUSTEES OF THE LELAND STANFORD JR. UNIV. (US) 1985-09-17 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-20170028075-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES PAM, UACA, FLT1 ALDH1A1 1885/4885KMT2A 2126/4885MAPT 2282/4885
US-20130136697-A1 INJECTABLE DENDRIMER HYDROGEL NANOPARTICLES UACA, PAM, JAK3 ALDH1A1 1369/4885KMT2A 2985/4885MAPT 3656/4885

“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.