SCHEMBL2210491

SCHEMBL2210491

Oc1ncnc2ncccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.41
KDM4E B2RXH2 10/20 0.40
HSP90AA1 P07900 8/20 0.40
HTT P42858 5/20 0.40
LMNA P02545 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
MAPT P10636 4/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
TDP1 Q9NUW8 4/20 0.40
TP53 P04637 3/20 0.40
SLC6A2 P23975 3/20 0.40
ALDH1A1 P00352 3/20 0.40
ALOX15 P16050 2/20 0.40
USP2 O75604 2/20 0.40
ALOX15B O15296 1/20 0.40
NR1I2 O75469 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTR1A P08908 1/20 0.40
ALOX5 P09917 1/20 0.40

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
SCHEMBL30880053 1.00 EGFR (0.41) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL31662896 0.74 L3MBTL1 (0.45) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL29427603 0.74 PI4KA (0.52) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL29427596 0.74 PI4KA (0.52) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL2041433 0.74 PI4KA (0.52) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL1065478 0.74 PDE4A (0.52) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL6837820 0.74 EGFR (0.41) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL30831937 0.74 PDE4A (0.52) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL12559949 0.74 EGFR (0.41) EGFRKDM4EHSP90AA1HTTLMNA
SCHEMBL29416394 0.74 PDE4A (0.52) EGFRKDM4EHSP90AA1HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3630759-B1 COMPOUNDS USEFUL AS ION CHANNEL INHIBITORS FOR THE TREATMENT OF CANCER CENTRE NAT RECH SCIENT (FR) 2024-05-01 EP disclosed
US-11932638-B2 Ion channel inhibitor compounds for cancer treatment CENTRE NATIONAL DE LA RECHERCHE SCIENTIFQUE (FR) 2024-03-19 US disclosed
US-20230212169-A9 PYRIDOPYRIMIDINES DERIVATIVES AS P2X3 INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2023-07-06 US disclosed
US-20210009581-A1 ION CHANNEL INHIBITOR COMPOUNDS FOR CANCER TREATMENT CHU NANTES (FR) 2021-01-14 US disclosed
US-20210009581-A1 ION CHANNEL INHIBITOR COMPOUNDS FOR CANCER TREATMENT CHU NANTES (FR) 2021-01-14 US disclosed
EP-3630759-A1 ION CHANNEL INHIBITOR COMPOUNDS FOR CANCER TREATMENT Centre National De La Recherche Scientifique (FR) 2020-04-08 EP disclosed
WO-2018215557-A1 ION CHANNEL INHIBITOR COMPOUNDS FOR CANCER TREATMENT CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-11-29 WO disclosed
US-20160152576-A9 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2016-06-02 US disclosed
US-20140148436-A1 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2014-05-29 US disclosed
US-8680114-B2 AKT protein kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2014-03-25 US disclosed
EP-0802914-B1 ARYL- AND HETEROARYL- PURINE AND PYRIDOPYRIMIDINE DERIVATIVES PHARMACIA & UPJOHN SPA (IT) 2001-06-06 EP disclosed
EP-0595467-B1 Process for preparing antifolate 4-hydroxypyrrolo 2,3-d pyrimidine derivatives LILLY CO ELI (US) 2000-07-19 EP disclosed
EP-1018514-A1 NF-$g(k)B INHIBITORS CONTAINING INDAN DERIVATIVES AS THE ACTIVE INGREDIENT SUNTORY LIMITED (JP) 2000-07-12 EP disclosed
US-5965563-A NOVEL PURINE DERIVATIVES SUCH AS N6-(2-OXINDOL-5-YL) ADENINE, METHODS OF SYNTHESIZING THEM; USE AS TYROSINE KINASE INHIBITORS PHARMACIA & UPJOHN S.P.A. (IT) 1999-10-12 US disclosed
EP-0802914-A1 ARYL AND HETEROARYL PURINE COMPOUNDS PHARMACIA & UPJOHN S.p.A. (IT) 1997-10-29 EP disclosed
WO-1997018212-A1 ARYL AND HETEROARYL PURINE COMPOUNDS PHARMACIA & UPJOHN S.P.A. (IT) 1997-05-22 WO disclosed
EP-0595467-A2 Process for preparing antifolate 4-hydroxypyrrolo 2,3-d pyrimidine derivatives ELI LILLY AND COMPANY (US) 1994-05-04 EP disclosed
US-5278307-A Process for preparing 4-hydroxypyrrolo(2,3-d)pyrimidine based antifolate compounds and intermediates ELI LILLY AND COMPANY (US) 1994-01-11 US disclosed
US-5223503-A Antitumor, anticarcinogenic agents ELI LILLY AND COMPANY (US) 1993-06-29 US disclosed
EP-0511792-A2 Pyridoprimidine derivatives as antineoplastic agents ELI LILLY AND COMPANY (US) 1992-11-04 EP 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 (5 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-11932638-B2 Ion channel inhibitor compounds for cancer treatment CACNA1E, KCNA1, KCNT1 EGFR 305/4885KDM4E 3118/4885HSP90AA1 879/4885
US-20140148436-A1 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 EGFR 187/4885KDM4E 2590/4885HSP90AA1 2085/4885
US-20160152576-A9 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 EGFR 187/4885KDM4E 2590/4885HSP90AA1 2085/4885
US-20230212169-A9 PYRIDOPYRIMIDINES DERIVATIVES AS P2X3 INHIBITORS P2RX3, P2RX5, P2RX1 EGFR 1611/4885KDM4E 3807/4885HSP90AA1 2731/4885
US-20210009581-A1 ION CHANNEL INHIBITOR COMPOUNDS FOR CANCER TREATMENT CACNA1E, KCNA1, KCNT1 EGFR 305/4885KDM4E 3118/4885HSP90AA1 879/4885

“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.