SCHEMBL15664461

SCHEMBL15664461

O=C(Nc1ccc(Cl)cc1)NC1CCN(c2ncnc3[nH]ccc23)CC1

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIT P10721 3/20 0.77
JAK1 P23458 1/20 0.64
BTK Q06187 6/20 0.60
PAK1 Q13153 6/20 0.60
AKT2 P31751 2/20 0.58
GSK3B P49841 2/20 0.58

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
SCHEMBL15664612 0.90 KIT (0.77) KITBTKPAK1AKT2GSK3B
SCHEMBL15664208 0.90 KIT (0.77) KITBTKPAK1
SCHEMBL15663962 0.89 KIT (0.68) KITJAK1BTKPAK1
SCHEMBL15664629 0.88 KIT (0.76) KITBTKPAK1
SCHEMBL15514864 0.87 KIT (0.76) KITJAK1BTKPAK1
SCHEMBL15664203 0.87 KIT (1.00) KITBTKPAK1AKT2GSK3B
SCHEMBL15664983 0.87 KIT (0.80) KITJAK1BTKPAK1AKT2
SCHEMBL15665072 0.87 KIT (0.76) KITJAK1BTKPAK1
SCHEMBL15664261 0.87 KIT (0.71) KITBTKPAK1AKT2GSK3B
SCHEMBL15664193 0.87 KIT (0.73) KITJAK1BTKPAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2892534-B1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2021-08-04 EP disclosed
US-10227357-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2019-03-12 US disclosed
US-10227357-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2019-03-12 US disclosed
US-20140128390-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2014-05-08 US disclosed
US-20140128390-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2014-05-08 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-10227357-B2 Compounds and methods for kinase modulation, and indications therefor KIT, PRKCH, PRKACA KIT 1/4885JAK1 111/4885BTK 197/4885
US-20140128390-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR KIT, PRKCH, PRKACA KIT 1/4885JAK1 111/4885BTK 197/4885

“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.