SCHEMBL18430380

SCHEMBL18430380

CC(C)(C)Cc1ccc2cc[nH]c2n1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.37
NUDT1 P36639 1/20 0.37
BRD4 O60885 1/20 0.36
APP P05067 1/20 0.32
MAPK1 P28482 1/20 0.31
CCR4 P51679 1/20 0.31

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
SCHEMBL4167148 0.79 AXL (0.41) AXLNUDT1BRD4APPMAPK1
SCHEMBL11888031 0.76 AXL (0.38) AXLNUDT1BRD4APP
SCHEMBL31283256 0.75 AXL (0.41) AXLNUDT1BRD4APPMAPK1
SCHEMBL6929283 0.75 CCR1 (0.50) AXLNUDT1BRD4APPMAPK1
SCHEMBL23429681 0.74 MAPT (0.35) MAPK1CCR4
SCHEMBL10130905 0.74 AXL (0.37) AXLNUDT1BRD4APPMAPK1
SCHEMBL5925823 0.74 AXL (0.37) AXLNUDT1BRD4APP
SCHEMBL18937795 0.74 MAPK1 (0.42) AXLNUDT1APPMAPK1
Hydrochloric Acid SCHEMBL4976930 0.73 AXL (0.39) AXLNUDT1BRD4APP
SCHEMBL18744848 0.73 PAK4 (0.36) MAPK1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230277534-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2023-09-07 US disclosed
US-11566003-B2 Isoquinolines as inhibitors of HPK1 GENENTECH, INC. (US) 2023-01-31 US disclosed
US-20210254000-A1 PROCESS FOR PRODUCING A T CELL COMPOSITION JUNO THERAPEUTICS, INC. (US) 2021-08-19 US disclosed
US-20210163417-A1 ISOQUINOLINES AS INHIBITORS OF HPK1 GENENTECH, INC. (US) 2021-06-03 US disclosed
US-10947216-B2 Amide compounds and method for making and using RIGEL PHARMACEUTICALS, INC. (US) 2021-03-16 US disclosed
US-10301280-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2019-05-28 US disclosed
US-20170349572-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2017-12-07 US disclosed
US-9555033-B2 Identification of LKB1 mutation as a predictive biomarker for sensitivity to TOR kinase inhibitors SIGNAL PHARMACEUTICALS, LLC (US) 2017-01-31 US 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-10947216-B2 Amide compounds and method for making and using IRAK1, IRAK2, IRAK3 AXL 556/4885NUDT1 1533/4885BRD4 103/4885
US-20210254000-A1 PROCESS FOR PRODUCING A T CELL COMPOSITION ICOS, CD4, NFATC1 AXL 402/4885NUDT1 4486/4885BRD4 4071/4885
US-20230277534-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, PRKACA, MAP3K13 AXL 1476/4885NUDT1 2217/4885BRD4 741/4885
US-10301280-B2 Compounds and methods for kinase modulation, and indications therefor KIT, PRKCH, PRKACA AXL 718/4885NUDT1 1004/4885BRD4 2471/4885
US-11566003-B2 Isoquinolines as inhibitors of HPK1 HIPK1, HIPK2, IP6K1 AXL 4640/4885NUDT1 967/4885BRD4 880/4885
US-20210163417-A1 ISOQUINOLINES AS INHIBITORS OF HPK1 HIPK1, HIPK2, IP6K1 AXL 4640/4885NUDT1 967/4885BRD4 880/4885
US-20170349572-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR KIT, PRKCH, PRKACA AXL 718/4885NUDT1 1004/4885BRD4 2471/4885

“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.