SCHEMBL43830

SCHEMBL43830

COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3OC1CC(NNC2CC(O[C@H]3C[C@](O)(C(=O)CO)Cc4c(O)c5c(c(O)c43)C(=O)c3c(OC)cccc3C5=O)OC(C)C2O)C(O)C(C)O1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.83
KMT2A Q03164 9/20 0.83
THRB P10828 8/20 0.83
BLM P54132 7/20 0.83
RECQL P46063 6/20 0.83
TOP2A P11388 5/20 0.83
TDP1 Q9NUW8 5/20 0.83
HIF1A Q16665 5/20 0.83
SMN1; SMN2 Q16637 5/20 0.83
BRCA1 P38398 5/20 0.83
MAPT P10636 4/20 0.83
MAPK1 P28482 4/20 0.83
HTT P42858 4/20 0.83
PTGS1 P23219 3/20 0.83
CHRM1 P11229 3/20 0.83
TBXA2R P21731 3/20 0.83
KDM4E B2RXH2 3/20 0.83
ALDH1A1 P00352 3/20 0.83
ABCB1 P08183 3/20 0.83
FYN P06241 2/20 0.83

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
Hydrochloric Acid SCHEMBL1771543 0.99 MEN1 (0.83) MEN1KMT2ATHRBBLMRECQL
Hydrochloric Acid SCHEMBL27900762 0.99 MEN1 (0.83) MEN1KMT2ATHRBBLMRECQL
SCHEMBL147968 0.97 MEN1 (0.79) MEN1KMT2ATHRBBLMRECQL
SCHEMBL22409662 0.97 MEN1 (0.80) MEN1KMT2ATHRBBLMRECQL
Doxorubicin SCHEMBL27834123 0.96 MEN1 (0.91) MEN1KMT2ATHRBBLMRECQL
SCHEMBL4586684 0.96 MEN1 (0.81) MEN1KMT2ATHRBBLMRECQL
SCHEMBL29048581 0.96 MEN1 (0.79) MEN1KMT2ATHRBBLMRECQL
SCHEMBL23117782 0.95 MEN1 (0.80) MEN1KMT2ATHRBBLMRECQL
SCHEMBL16622415 0.95 MEN1 (0.80) MEN1KMT2ATHRBBLMRECQL
SCHEMBL20307182 0.95 MEN1 (0.80) MEN1KMT2ATHRBBLMRECQL

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

Appears in 3287 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023227018-A1 FUSION PROTEIN TARGETING CELL MEMBRANE RECEPTOR PROTEINS AND USE THEREOF 羿尊生物医药(浙江)有限公司 2023-11-30 WO claimed
WO-2023222019-A1 LIGAND-DRUG CONJUGATE AND USE THEREOF 成都百利多特生物药业有限责任公司 2023-11-23 WO claimed
WO-2023141560-A2 ALKALINE PHOSPHATASE FOR USE IN ONCOLOGY SYNTHETIC BIOLOGICS, INC. (US) 2023-07-27 WO claimed
US-20220298252-A1 METHODS OF TREATING CANCER USING TNFRSF25 ANTIBODIES PELICAN THERAPEUTICS, INC. 2022-09-22 US claimed
EP-4021494-A1 METHODS OF TREATING CANCER USING TNFRSF25 ANTIBODIES Pelican Therapeutics, Inc. (US) 2022-07-06 EP claimed
US-20220185863-A1 COMBINATION THERAPIES SHATTUCK LABS, INC. 2022-06-16 US claimed
CN-114502195-A Methods of treating cancer using TNFRSF25 antibodies 派立卡恩治疗公司 2022-05-13 CN claimed
WO-2022081521-A1 INOSITOL-BISPYROPHOSPHATE-DERIVED COMPOUNDS AND USES THEREOF NICOLAU YVES CLAUDE (US) 2022-04-21 WO claimed
EP-3930851-A1 COMBINATION THERAPIES Shattuck Labs, Inc. (US) 2022-01-05 EP claimed
CN-113747947-A Combination therapy 沙塔克实验室有限公司 2021-12-03 CN claimed
EP-2508184-A1 Pyridopyrazine derivatives and their use Æterna Zentaris GmbH (DE) 2012-10-10 EP claimed
JP-4701159-B2 2011-06-15 JP claimed
EP-1962854-A2 PYRIDOPYRAZINE DERIVATIVES AND USE THEREOF AS MODULATORS OF THE SIGNAL TRANSDUCTION PATHS AEterna Zentaris GmbH (DE) 2008-09-03 EP claimed
EP-1957487-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES AEterna Zentaris GmbH (DE) 2008-08-20 EP claimed
WO-2007149103-A2 VASCULAR TISSUE ENHANCEMENT AND SELECTIVE DESTRUCTION OF CANCEROUS CELLULAR TISSUE KAISER DANIEL E (US) 2007-12-27 WO claimed
WO-2007079999-A2 PYRIDOPYRAZINE DERIVATIVES AND USE THEREOF AS MODULATORS OF THE SIGNAL TRANSDUCTION PATHS ÆTERNA ZENTARIS GMBH (DE) 2007-07-19 WO claimed
US-20070123494-A1 PYRIDOPYRAZINE DERIVATIVES AND THEIR USE ZENTARIS GMBH (DE) 2007-05-31 US claimed
EP-1790342-A1 Pyridopyrazine derivatives and their use as signal transduction modulators Zentaris GmbH (DE) 2007-05-30 EP claimed
WO-2007054556-A1 NOVEL PYRIDOPYRAZINES AND THEIR USE AS MODULATORS OF KINASES ÆTERNA ZENTARIS GMBH (DE) 2007-05-18 WO claimed
EP-1785423-A1 Pyridopyrazine derivatives and their use as kinase modulators Zentaris GmbH (DE) 2007-05-16 EP claimed