SCHEMBL16167174

SCHEMBL16167174

Cc1cc(Br)cc2c(=O)[nH]c(=O)[nH]c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.39
KDM4E B2RXH2 3/20 0.39
HSD17B10 Q99714 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP1A2 P05177 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PARP4 Q9UKK3 2/20 0.38
PARP1 P09874 2/20 0.38
PARP2 Q9UGN5 1/20 0.38
GRIN2D O15399 2/20 0.36
GRIN3B O60391 2/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2A Q12879 2/20 0.36
GRIN2B Q13224 2/20 0.36
GRIN2C Q14957 2/20 0.36
GRIN3A Q8TCU5 2/20 0.36
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7032385 0.81 MAPT (0.40) GSK3BKDM4EALDH1A1GAAMAPT
SCHEMBL8807640 0.81 HSD17B10 (0.52) KDM4EHSD17B10ALDH1A1CYP1A2GAA
SCHEMBL5794646 0.78 PGR (0.43) KDM4EHSD17B10ALDH1A1CYP1A2GAA
SCHEMBL22393852 0.78 PGR (0.37) GSK3BKDM4EALDH1A1MAPTPARP1
SCHEMBL7026627 0.78 IDH1 (0.35) GSK3BKDM4EHSD17B10ALDH1A1CYP1A2
SCHEMBL30504352 0.78 PGR (0.37) GSK3BKDM4EALDH1A1MAPTPARP1
SCHEMBL17883917 0.78 KDM4E (0.36) GSK3BKDM4EALDH1A1PARP1HPGD
SCHEMBL27101008 0.78 TYMP (0.42) KDM4EHSD17B10ALDH1A1CYP1A2GAA
SCHEMBL16166967 0.77 KDM4E (0.51) KDM4EALDH1A1PARP2GRIN2DGRIN3B
SCHEMBL24665377 0.77 GSK3B (0.46) GSK3BKDM4EHSD17B10PARP4PARP1

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
EP-3960735-B1 QUINAZOLINE DERIVATIVES USED TO TREAT HIV GILEAD SCIENCES INC (US) 2023-09-13 EP disclosed
US-20210113578-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC 2021-04-22 US disclosed
US-20210113578-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC 2021-04-22 US disclosed
US-20210087290-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES ENCEFA (FR) 2021-03-25 US disclosed
US-10912779-B2 Quinazolines and azaquinazolines as dual inhibitors of RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/mTOR pathways ASANA BIOSCIENCES, LLC (US) 2021-02-09 US disclosed
US-10912779-B2 Quinazolines and azaquinazolines as dual inhibitors of RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/mTOR pathways ASANA BIOSCIENCES, LLC (US) 2021-02-09 US disclosed
US-10869872-B2 2020-12-22 US disclosed
US-10869872-B2 2020-12-22 US disclosed
EP-3658586-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES ENCEFA (FR) 2020-06-03 EP disclosed
CN-111108127-A Compounds that specifically bind CD38 for use in the treatment of neurodegenerative and inflammatory diseases ENCEFA公司 2020-05-05 CN disclosed
US-20170027953-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC (US) 2017-02-02 US disclosed
US-9499495-B2 Quinazolines and azaquinazolines as dual inhibitors of RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/mTOR pathways ASANA BIOSCIENCES, LLC (US) 2016-11-22 US disclosed
US-9499495-B2 Quinazolines and azaquinazolines as dual inhibitors of RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/mTOR pathways ASANA BIOSCIENCES, LLC (US) 2016-11-22 US disclosed
US-9499495-B2 Quinazolines and azaquinazolines as dual inhibitors of RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/mTOR pathways ASANA BIOSCIENCES, LLC (US) 2016-11-22 US disclosed
US-20160068496-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC (US) 2016-03-10 US disclosed
US-20160068496-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC (US) 2016-03-10 US disclosed
US-20160068496-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC (US) 2016-03-10 US disclosed
EP-2984088-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS Asana BioSciences, LLC (US) 2016-02-17 EP disclosed
WO-2014169167-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC (US) 2014-10-16 WO disclosed
WO-2014169167-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC (US) 2014-10-16 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 (6 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-20160068496-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS NRAS, KRAS, BRAF GSK3B 1091/4885KDM4E 376/4885HSD17B10 4635/4885
US-20210087290-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES CD38, TRPC1, TRPC4 GSK3B 4243/4885KDM4E 3720/4885HSD17B10 3083/4885
US-10869872-B2 NRAS, KRAS, BRAF GSK3B 1152/4885KDM4E 293/4885HSD17B10 4756/4885
US-20170027953-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS NRAS, KRAS, BRAF GSK3B 1084/4885KDM4E 386/4885HSD17B10 4634/4885
US-20210113578-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS NRAS, KRAS, BRAF GSK3B 1084/4885KDM4E 386/4885HSD17B10 4634/4885
US-10912779-B2 Quinazolines and azaquinazolines as dual inhibitors of RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/mTOR pathways NRAS, KRAS, BRAF GSK3B 1084/4885KDM4E 386/4885HSD17B10 4634/4885

“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.