SCHEMBL16166753

SCHEMBL16166753

COc1cc2[nH]c(=O)[nH]c(=O)c2cc1Br

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.75
ALDH1A1 P00352 3/20 0.75
HPGD P15428 3/20 0.75
SMN1; SMN2 Q16637 1/20 0.75
GRIN2D O15399 2/20 0.62
GRIN3B O60391 2/20 0.62
GRIN1 Q05586 2/20 0.62
GRIN2A Q12879 2/20 0.62
GRIN2B Q13224 2/20 0.62
GRIN2C Q14957 2/20 0.62
GRIN3A Q8TCU5 2/20 0.62
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PDE3B Q13370 6/20 0.41
PDE3A Q14432 6/20 0.41
AXL P30530 1/20 0.41
IMPDH2 P12268 1/20 0.41
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL28500138 0.93 KDM4E (0.75) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL2895978 0.86 KDM4E (1.00) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL24931754 0.80 KDM4E (0.75) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL10955203 0.80 ALDH1A1 (0.75) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL7034913 0.80 KDM4E (0.53) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL4256786 0.80 GRIN2D (0.60) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL31609245 0.80 GRIN2D (0.60) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL25365592 0.78 KDM4E (0.77) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D
SCHEMBL6808565 0.77 ALDH1A1 (0.65) KDM4EALDH1A1HPGDSMN1; SMN2PDE3B
SCHEMBL16896940 0.77 GRIN2D (0.57) KDM4EALDH1A1HPGDSMN1; SMN2GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240109891-A1 NOVEL SUBSTITUTED TRICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2024-04-04 US disclosed
CN-117561258-A Novel substituted tricyclic aza heterocycles as SOS1 inhibitors 唯久生物技术(苏州)有限公司 2024-02-13 CN disclosed
WO-2022187236-A1 NOVEL SUBSTITUTED TRICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS VIVA STAR BIOSCIENCES (SUZHOU) CO., LTD. (CN) 2022-09-09 WO 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-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
US-20190151327-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS ASANA BIOSCIENCES, LLC 2019-05-23 US 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 (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-20160068496-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS NRAS, KRAS, BRAF KDM4E 376/4885ALDH1A1 3747/4885HPGD 2852/4885
US-20190151327-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS NRAS, KRAS, BRAF KDM4E 386/4885ALDH1A1 3815/4885HPGD 2851/4885
US-20240109891-A1 NOVEL SUBSTITUTED TRICYCLIC AZA-HETEROCYCLES AS SOS1 INHIBITORS SOS1, SOS2, KSR1 KDM4E 2082/4885ALDH1A1 4112/4885HPGD 3738/4885
US-10869872-B2 NRAS, KRAS, BRAF KDM4E 293/4885ALDH1A1 3639/4885HPGD 3014/4885
US-20170027953-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS NRAS, KRAS, BRAF KDM4E 386/4885ALDH1A1 3815/4885HPGD 2851/4885
US-20210113578-A1 QUINAZOLINES AND AZAQUINAZOLINES AS DUAL INHIBITORS OF RAS/RAF/MEK/ERK AND PI3K/AKT/PTEN/MTOR PATHWAYS NRAS, KRAS, BRAF KDM4E 386/4885ALDH1A1 3815/4885HPGD 2851/4885
US-10912779-B2 Quinazolines and azaquinazolines as dual inhibitors of RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/mTOR pathways NRAS, KRAS, BRAF KDM4E 386/4885ALDH1A1 3815/4885HPGD 2851/4885

“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.