SCHEMBL1958366

SCHEMBL1958366

CCCCCOC(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.60
BCL9 O00512 1/20 0.58
CTNNB1 P35222 1/20 0.58
HTR2A P28223 1/20 0.54
MAPT P10636 5/20 0.52
CRHBP P24387 1/20 0.52
CRHR2 Q13324 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 2/20 0.50
GAA P10253 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
ALOX12 P18054 1/20 0.49
PKM P14618 1/20 0.47
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ESR1 P03372 1/20 0.45

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
SCHEMBL26980348 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL26976962 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL10685191 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL21433889 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL21433828 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL2234364 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL9846659 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL21433779 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL21777065 0.99 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT
SCHEMBL1144551 0.97 MGLL (0.62) MGLLBCL9CTNNB1HTR2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011067588-A1 CYCLIC SULPHINYL ESTERS OF CYTIDINE GENERICS [UK] LIMITED (GB) 2011-06-09 WO claimed
US-12637441-B2 Prodrugs of the tyrosine kinase inhibitor for treating cancer Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2026-05-26 US disclosed
WO-2024259930-A9 PHOSPHONATE COMPOUND AND MEDICAL USE THEREOF 润佳(苏州)医药科技有限公司 2025-04-24 WO disclosed
WO-2024259930-A1 PHOSPHONATE COMPOUND AND MEDICAL USE THEREOF 润佳(苏州)医药科技有限公司 2024-12-26 WO disclosed
CN-117285566-A Phosphonate compound and medical application thereof 润佳(苏州)医药科技有限公司 2023-12-26 CN disclosed
CN-112442011-B Prodrug compound and application thereof in treating cancers 润佳(苏州)医药科技有限公司 2023-11-14 CN disclosed
EP-4021912-A1 PRODRUGS OF THE TYROSINE KINASE INHIBITOR FOR TREATING CANCER Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2022-07-06 EP disclosed
US-20210078970-A1 PRODRUGS OF THE TYROSINE KINASE INHIBITOR FOR TREATING CANCER Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2021-03-18 US disclosed
CN-112442011-A Prodrug compound and application thereof in treating cancer 润佳(苏州)医药科技有限公司 2021-03-05 CN disclosed
WO-2021035360-A1 PRODRUGS OF THE TYROSINE KINASE INHIBITOR FOR TREATING CANCER Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2021-03-04 WO disclosed
US-20080319016-A1 Novel Arylamidine Derivative, Salt Thereof, and Antifungal Containing These TOYAMA CHEMICAL CO., LTD. (JP) 2008-12-25 US disclosed
US-20080319016-A1 Novel Arylamidine Derivative, Salt Thereof, and Antifungal Containing These TOYAMA CHEMICAL CO., LTD. (JP) 2008-12-25 US disclosed
EP-1767526-A1 NOVEL ARYLAMIDINE DERIVATIVE, SALT THEREOF, AND ANTIFUNGAL CONTAINING THESE TOYAMA CHEMICAL CO., LTD. (JP) 2007-03-28 EP disclosed
EP-1767526-A1 NOVEL ARYLAMIDINE DERIVATIVE, SALT THEREOF, AND ANTIFUNGAL CONTAINING THESE TOYAMA CHEMICAL CO., LTD. (JP) 2007-03-28 EP disclosed
EP-1383731-A4 BIARYL COMPOUNDS AS SERINE PROTEASE INHIBITORS BIOCRYST PHARM INC (US) 2005-09-28 EP disclosed
US-6936719-B2 Biaryl compounds as serine protease inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2005-08-30 US disclosed
US-20040162281-A1 Biaryl compounds as serine protease inhibitors BIOCRYST PHARMACEUTICALS, INC. 2004-08-19 US disclosed
US-6699994-B1 ANTICOAGULANTS; INHIBITORS OF THROMBIN, BLOOD COAGULATION FACTORS VIIA, XA, FVIIA, TISSUE FACTOR, AND TRYPSIN BIOCRYST PHARMACEUTICALS, INC. 2004-03-02 US disclosed
EP-1383731-A1 BIARYL COMPOUNDS AS SERINE PROTEASE INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2004-01-28 EP disclosed
WO-2002034711-A1 BIARYL COMPOUNDS AS SERINE PROTEASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2002-05-02 WO 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 (4 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-20210078970-A1 PRODRUGS OF THE TYROSINE KINASE INHIBITOR FOR TREATING CANCER ABL1, FLT3, SRC MGLL 2065/4885BCL9 849/4885CTNNB1 3582/4885
US-20040162281-A1 Biaryl compounds as serine protease inhibitors TFPI, SPINT2, TFPI2 MGLL 730/4885BCL9 1884/4885CTNNB1 2972/4885
US-12637441-B2 Prodrugs of the tyrosine kinase inhibitor for treating cancer EGFR, ERBB2, MET MGLL 2427/4885BCL9 361/4885CTNNB1 1180/4885
US-20080319016-A1 Novel Arylamidine Derivative, Salt Thereof, and Antifungal Containing These NAT1, ERG28, SLC7A1 MGLL 4060/4885BCL9 2727/4885CTNNB1 4793/4885

“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.