SCHEMBL2289401

SCHEMBL2289401

CCCc1ccc(N=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.47
LPL P06858 2/20 0.45
LIPG Q9Y5X9 2/20 0.45
MGLL Q99685 1/20 0.44
PLK1 P53350 1/20 0.44
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
HIF1A Q16665 1/20 0.43
THRB P10828 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 2/20 0.39
CTDSP1 Q9GZU7 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL13746337 0.87 PLK1 (0.51) PLK1ALDH1A1THRBL3MBTL1POLB
SCHEMBL21699897 0.86 CYP3A4 (0.53) CA2PLK1ALDH1A1HSD17B10TP53
SCHEMBL13747158 0.84 PLK1 (0.45) CA2LPLLIPGPLK1ALDH1A1
SCHEMBL20852371 0.80 LPL (0.48) CA2LPLLIPGMGLLPLK1
SCHEMBL8267536 0.80 PLAU (0.52) CA2LPLLIPGMGLLPLK1
SCHEMBL142480 0.79 LPL (0.62) CA2LPLLIPGMGLLPLK1
SCHEMBL18688625 0.78 ALDH1A1 (0.46) ALDH1A1HSD17B10TP53TSHRMAPK1
SCHEMBL9218575 0.77 ALDH1A1 (0.52) PLK1ALDH1A1HSD17B10TP53TSHR
SCHEMBL23142745 0.76 LPL (0.45) CA2LPLLIPGMGLLPLK1
SCHEMBL8423871 0.76 NOS3 (0.55) CA2ALDH1A1TP53TSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1270573-B1 Xanthine and phenazone acesulfam-H complexes with improved taste, process for their preparation and their use NUTRINOVANUTRITION SPECIALTIES (DE) 2004-09-01 EP claimed
EP-1270573-A1 Xanthine and phenazone acesulfam-H complexes with improved taste, process for their preparation and their use Nutrinova Nutrition Specialties & Food Ingredients GmbH (DE) 2003-01-02 EP claimed
WO-1998052616-A2 NONSTEROIDAL ANTIRHEUMATIC AGENTS OR THROMBOCYTE-AGGLUTINATION INHIBITORS TO IMPROVE REPRESENTATION OF VESSELS, LYMPH NODES AND BONE MARROW WITH PHARMACEUTICAL PREPARATIONS CONTAINING PARTICLES, VESICLES OF POLYMERS Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 1998-11-26 WO claimed
EP-4212181-A2 METHYLENE CARBAMATE LINKERS FOR USE WITH TARGETED-DRUG CONJUGATES Seagen Inc. (US) 2023-07-19 EP disclosed
WO-2023083919-A1 CONJUGATES COMPRISING A PHOSPHORUS (V) AND A CAMPTOTHECIN MOIETY TUBULIS GMBH (DE) 2023-05-19 WO disclosed
WO-2021067861-A1 CAMPTOTHECIN PEPTIDE CONJUGATES SEAGEN INC. (US) 2021-04-08 WO disclosed
EP-3756663-A1 PEGYLATED DRUG-LINKERS FOR IMPROVED LIGAND-DRUG CONJUGATE PHARMACOKINETICS Seagen Inc. (US) 2020-12-30 EP disclosed
EP-3057585-B1 PEGYLATED DRUG-LINKERS FOR IMPROVED LIGAND-DRUG CONJUGATE PHARMACOKINETICS SEATTLE GENETICS INC (US) 2020-07-22 EP disclosed
EP-3281643-A2 RADIOACTIVE PROBE FOR DETECTING HYDROGEN SULFIDE Kyungpook National University Industry-Academic Cooperation Foundation (KR) 2018-02-14 EP disclosed
US-9688617-B2 Photoreactive synthetic regulator of protein function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-06-27 US disclosed
WO-2017020972-A1 PYRROLOBENZODIAZEPINE-ANTIBODY CONJUGATES VAN BERKEL, Patricius Hendrikus Cornelis (CH) 2017-02-09 WO disclosed
EP-1270573-B1 Xanthine and phenazone acesulfam-H complexes with improved taste, process for their preparation and their use NUTRINOVANUTRITION SPECIALTIES (DE) 2004-09-01 EP disclosed
EP-0475160-B2 Preparation for drug application in minute droplet form IDEA AG (DE) 2004-07-14 EP disclosed
EP-1270573-A1 Xanthine and phenazone acesulfam-H complexes with improved taste, process for their preparation and their use Nutrinova Nutrition Specialties & Food Ingredients GmbH (DE) 2003-01-02 EP disclosed
US-6165500-A Preparation for the application of agents in mini-droplets IDEA AG (DE) 2000-12-26 US disclosed
WO-1998052616-A2 NONSTEROIDAL ANTIRHEUMATIC AGENTS OR THROMBOCYTE-AGGLUTINATION INHIBITORS TO IMPROVE REPRESENTATION OF VESSELS, LYMPH NODES AND BONE MARROW WITH PHARMACEUTICAL PREPARATIONS CONTAINING PARTICLES, VESICLES OF POLYMERS Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 1998-11-26 WO disclosed
EP-0475160-B1 Preparation for drug application in minute droplet form IDEA AG (DE) 1996-02-14 EP disclosed
EP-0475160-A1 Preparation for drug application in minute droplet form Cevc, Gregor, Prof. Dr. (DE) 1992-03-18 EP disclosed
WO-1992003122-A1 PREPARATION FOR APPLICATION OF ACTIVE SUBSTANCES IN THE FORM OF MINIMUM-SIZED DROPLETS CEVC GREGOR (DE) 1992-03-05 WO disclosed
EP-0007572-B1 PHARMACEUTICAL MIXTURES CONTAINING AN AMANTADINE COMPOUND CIBA-GEIGY AG (CH) 1983-04-27 EP disclosed