SCHEMBL300397

SCHEMBL300397

C=CCOC(=O)OCC(C)c1cc2c(cc1[N+](=O)[O-])OCO2

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.44
ALDH1A1 P00352 11/20 0.42
LMNA P02545 3/20 0.42
MAPT P10636 8/20 0.40
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 2/20 0.39
MCL1 Q07820 1/20 0.39
KDM4E B2RXH2 9/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 2/20 0.38
RAB9A P51151 1/20 0.37
THRB P10828 1/20 0.37
RECQL P46063 1/20 0.37
F2 P00734 1/20 0.37
RCE1 Q9Y256 1/20 0.37
MET P08581 1/20 0.37

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
SCHEMBL3759745 0.91 SRC (0.51) SRCALDH1A1LMNAMAPTKMT2A
SCHEMBL3759750 0.83 SRC (0.50) SRCALDH1A1LMNAMAPTKMT2A
SCHEMBL3759748 0.83 SRC (0.50) SRCALDH1A1LMNAMAPTKMT2A
SCHEMBL12050503 0.83 ALDH1A1 (0.53) SRCALDH1A1LMNAMAPTKMT2A
SCHEMBL12050506 0.82 SRC (0.49) SRCALDH1A1LMNAMAPTKMT2A
SCHEMBL14782111 0.77 SRC (0.48) SRCALDH1A1LMNAMAPTKMT2A
SCHEMBL3325640 0.76 ALDH1A1 (0.48) SRCALDH1A1LMNAMAPTL3MBTL1
SCHEMBL3326580 0.75 SRC (0.47) SRCALDH1A1LMNAMAPTKMT2A
SCHEMBL3325844 0.74 SRC (0.57) SRCALDH1A1LMNAMAPTKMT2A
SCHEMBL3326237 0.74 SRC (0.48) SRCALDH1A1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024074604-A1 COMPOUNDS FOR THE MANAGEMENT OF CELL STEMNESS AND INVASION IN CANCER AND RELATED DISEASES INSTITUTO BIOMAR, S.A (ES) 2024-04-11 WO disclosed
EP-4349409-A1 COMPOUNDS FOR THE MANAGEMENT OF CELL STEMNESS AND INVASION IN CANCER AND RELATED DISEASES Instituto Biomar S.A. (ES) 2024-04-10 EP disclosed
EP-3898613-B1 ANTICANCER COMPOUNDS PHARMA MAR SA (ES) 2023-08-09 EP disclosed
US-20220056021-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A. (ES) 2022-02-24 US disclosed
EP-3898613-A1 ANTICANCER COMPOUNDS Pharma Mar S.A. (ES) 2021-10-27 EP disclosed
US-20210317490-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A., (ES) 2021-10-14 US disclosed
WO-2020127194-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A. (ES) 2020-06-25 WO disclosed
US-20200140450-A1 CHEMICAL METHOD OF PRODUCING SMTP GROUPS OR SMTP-7 AND INTERMEDIATES USED IN THE METHOD SHOWA UNIVERSITY (JP) 2020-05-07 US disclosed
US-10414745-B2 Phenol derivatives to treat cancer FUNDACIÓN MEDINA. CENTRO DE EXCELENCIA EN INVESTIGACIÓN DE MEDICAMENTOS INNOVADORES EN ANDALUCÍA (ES) 2019-09-17 US disclosed
WO-2018167270-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A. (ES) 2018-09-20 WO disclosed
US-20100280108-A1 Antitumoral Compounds PHARMA MAR, S.A. (ES) 2010-11-04 US disclosed
EP-2231633-A1 ANTITUMORAL COMPOUNDS Pharma Mar S.A. (ES) 2010-09-29 EP disclosed
EP-2231590-A1 ANTITUMORAL COMPOUNDS Pharma Mar S.A. (ES) 2010-09-29 EP disclosed
US-20100196811-A1 HIGHLY DISPERSE METAL OXIDES HAVING A HIGH POSITIVE SURFACE CHARGE WACKER CHEMIE AG (DE) 2010-08-05 US disclosed
US-20100048690-A2 ANTITUMORAL DIHYDROPYRAN-2-ONE COMPOUNDS PHARMA MAR, S.A. (ES) 2010-02-25 US disclosed
US-20090186938-A1 ANTITUMORAL DIHYDROPYRAN-2-ONE COMPOUNDS PHARMA MAR, S.A. (ES) 2009-07-23 US disclosed
WO-2009080761-A1 ANTITUMORAL COMPOUNDS PHARMA MAR, S.A. (ES) 2009-07-02 WO disclosed
WO-2009080769-A1 ANTITUMORAL COMPOUNDS PHARMA MAR, S.A. (ES) 2009-07-02 WO disclosed
EP-2032551-A1 ANTITUMORAL DIHYDROPYRAN-2-ONE COMPOUNDS PHARMA MAR, S.A. (ES) 2009-03-11 EP disclosed
WO-2007144423-A1 ANTITUMORAL DIHYDROPYRAN-2-ONE COMPOUNDS PHARMA MAR, S.A. (ES) 2007-12-21 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 (7 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-10414745-B2 Phenol derivatives to treat cancer RB1, TP53, NCOR1 SRC 654/4885ALDH1A1 454/4885LMNA 3155/4885
US-20100048690-A2 ANTITUMORAL DIHYDROPYRAN-2-ONE COMPOUNDS RPLP1, PKD1, KRAS SRC 2515/4885ALDH1A1 1692/4885LMNA 1728/4885
US-20210317490-A1 ANTICANCER COMPOUNDS SLC75A1, SLC15A1, LCT SRC 3014/4885ALDH1A1 947/4885LMNA 1138/4885
US-20200140450-A1 CHEMICAL METHOD OF PRODUCING SMTP GROUPS OR SMTP-7 AND INTERMEDIATES USED IN THE METHOD TST, SMS, TMSB4X SRC 2225/4885ALDH1A1 3911/4885LMNA 1028/4885
US-20220056021-A1 ANTICANCER COMPOUNDS TP53, MCL1, MYC SRC 2396/4885ALDH1A1 796/4885LMNA 1756/4885
US-20090186938-A1 ANTITUMORAL DIHYDROPYRAN-2-ONE COMPOUNDS RPLP1, PKD1, KRAS SRC 2515/4885ALDH1A1 1692/4885LMNA 1728/4885
US-20100280108-A1 Antitumoral Compounds TPD52L2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TP53 SRC 2723/4885ALDH1A1 1599/4885LMNA 3517/4885

“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.