SCHEMBL18937795

SCHEMBL18937795

CC(C)(C)Cc1cnc2cc[nH]c2n1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 13/20 0.42
RIPK1 Q13546 1/20 0.33
APP P05067 1/20 0.33
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
JAK3 P52333 1/20 0.31
PDE10A Q9Y233 2/20 0.31
AXL P30530 1/20 0.31
NUDT1 P36639 1/20 0.31
FGFR1 P11362 1/20 0.31
KDR P35968 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
SCHEMBL18937634 0.87 MAPK1 (0.54) MAPK1RIPK1JAK2JAK1JAK3
SCHEMBL12810052 0.81 MAPK1 (0.44) MAPK1RIPK1APPPDE10AAXL
SCHEMBL18937802 0.78 PDE10A (0.32) JAK2PDE10A
SCHEMBL21335023 0.75 KDM4E (0.33)
SCHEMBL18430380 0.74 AXL (0.37) MAPK1APPAXLNUDT1
SCHEMBL21025526 0.74 MAPK1 (0.44) MAPK1RIPK1APPAXLNUDT1
SCHEMBL9968617 0.72 PDE10A (0.62) PDE10A
SCHEMBL18937797 0.71 KDM4E (0.37)
SCHEMBL10141177 0.71 MAPK1 (0.48) MAPK1RIPK1APPJAK2JAK1
SCHEMBL12847281 0.71 MAPK1 (0.71) MAPK1RIPK1APPAXLNUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11337976-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2022-05-24 US disclosed
US-20170157120-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. (US) 2017-06-08 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 (2 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-11337976-B2 Compounds and methods for kinase modulation, and indications therefor MAP3K20, PRKACA, MAP3K13 MAPK1 97/4885RIPK1 492/4885APP 4662/4885
US-20170157120-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, PRKACA, MAP3K13 MAPK1 97/4885RIPK1 492/4885APP 4662/4885

“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.