SCHEMBL738474

SCHEMBL738474

[CH2]CCCc1ncccn1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.44
HDAC8 Q9BY41 1/20 0.35

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
SCHEMBL1325192 0.92 NAAA (0.47) NAAA
SCHEMBL10681615 0.90 NAAA (0.50) NAAA
SCHEMBL9319665 0.90 NAAA (0.50) NAAA
SCHEMBL8151755 0.90 NAAA (0.50) NAAA
SCHEMBL356946 0.83
SCHEMBL4719861 0.77 HSP90AA1 (0.32)
SCHEMBL3030404 0.74 NAAA (0.48) NAAA
SCHEMBL29104167 0.74 NAAA (0.48) NAAA
SCHEMBL20561036 0.74 NAAA (0.44) NAAA
SCHEMBL8011559 0.74 NAAA (0.44) NAAAHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230330243-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATR INHIBITOR DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-10-19 US disclosed
CN-116635082-A Combination of antibody-drug conjugate and ATR inhibitor 阿斯利康(英国)有限公司 2023-08-22 CN disclosed
WO-2023126823-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATR INHIBITOR ASTRAZENECA UK LIMITED (GB) 2023-07-06 WO disclosed
EP-4171650-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATR INHIBITOR AstraZeneca UK Limited (GB) 2023-05-03 EP disclosed
WO-2021260582-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND AURORA B INHIBITOR ASTRAZENECA UK LIMITED (GB) 2021-12-30 WO disclosed
WO-2021260579-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATR INHIBITOR ASTRAZENECA UK LIMITED (GB) 2021-12-30 WO disclosed
US-9567358-B2 Methods of treatment using N-(3-fluorophenyl)-2-{3-[(7-{3-[ethyl(2-hydroxyethyl)amino]propoxy}-quinazolin-4-yl)amino]-1H-pyrazol-5-yl}acetamide ASTRAZENECA AB (SE) 2017-02-14 US disclosed
US-9421213-B2 Chemical compounds ASTRAZENECA AB (SE) 2016-08-23 US disclosed
US-20160074412-A1 Chemical Compounds ASTRAZENECA AB (SE) 2016-03-17 US disclosed
US-20150307534-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2015-10-29 US disclosed
WO-2004058752-A1 QUINAZOLINE COMPOUNDS ASTRAZENECA AB (SE) 2004-07-15 WO disclosed
WO-2004058781-A1 PHOSPHONOOXY QUINAZOLINE DERIVATIVES AND THEIR PHARMACEUTICAL USE ASTRAZENECA AB (SE) 2004-07-15 WO disclosed
WO-2004024715-A1 SULPHONAMIDE DERIVATIVES AND THEIR USE AS TACE INHIBITORS ASTRAZENECA AB (SE) 2004-03-25 WO disclosed
WO-2004024698-A1 1-SULPHONYL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2004-03-25 WO disclosed
WO-2004024721-A1 HYDANTOIN DERIVATIVES UND DEREN VERWENDUNG ALS TACE INHIBITOREN ASTRAZENECA AB (SE) 2004-03-25 WO disclosed
US-20030212116-A1 Heterocyclic imino compounds and fungicides and insecticides for agricultural and horitcultural use NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-11-13 US disclosed
EP-1243580-A1 HETEROCYCLIC IMINO COMPOUNDS AND FUNGICIDES AND INSECTICIDES FOR AGRICULTURAL AND HORTICULTURAL USE Nissan Chemical Industries, Ltd. (JP) 2002-09-25 EP disclosed
US-5606078-A ANTIHYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-02-25 US disclosed
EP-0678514-A1 3,5-Disubstituted tetrahydrofuran-2-ones CIBA-GEIGY AG (CH) 1995-10-25 EP disclosed
EP-0678500-A1 Alpha-amino alkanoic acids and reduction products as intermediates in the preparation of renin inhibitors CIBA-GEIGY AG (CH) 1995-10-25 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 (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-20030212116-A1 Heterocyclic imino compounds and fungicides and insecticides for agricultural and horitcultural use DDT, CBR3, CYP1B1 NAAA 3349/4885HDAC8 1673/4885
US-20150307534-A1 CHEMICAL COMPOUNDS ABL1, NQO1, NQO2 NAAA 1841/4885HDAC8 1826/4885
US-20160074412-A1 Chemical Compounds CYP2C19, ABCG2, CYP2C9 NAAA 3741/4885HDAC8 3840/4885
US-20230330243-A1 COMBINATION OF ANTIBODY-DRUG CONJUGATE AND ATR INHIBITOR ATR, ERBB2, ATRIP NAAA 1048/4885HDAC8 704/4885

“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.