SCHEMBL15515641

SCHEMBL15515641

O=C(Nc1ccc(Cl)cc1)N1CCN(c2ncnc3[nH]ccc23)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KIT P10721 7/20 1.00
AKT1 P31749 7/20 0.65
PDGFRB P09619 2/20 0.62
PDGFRA P16234 1/20 0.62
JAK1 P23458 1/20 0.60
GOT1 P17174 1/20 0.59
RPS6KB1 P23443 1/20 0.57

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
SCHEMBL15664214 0.89 KIT (0.80) KITAKT1PDGFRB
SCHEMBL15664356 0.89 KIT (0.80) KITPDGFRBGOT1
SCHEMBL15664616 0.88 KIT (0.78) KITAKT1PDGFRBPDGFRARPS6KB1
SCHEMBL15516379 0.87 KIT (0.77) KITAKT1PDGFRBGOT1RPS6KB1
SCHEMBL15664654 0.86 KIT (1.00) KITAKT1PDGFRBJAK1
SCHEMBL15664785 0.86 KIT (1.00) KITAKT1PDGFRB
SCHEMBL15664363 0.86 KIT (0.76) KITAKT1PDGFRBPDGFRAGOT1
SCHEMBL15518672 0.86 KIT (1.00) KITAKT1JAK1GOT1
SCHEMBL15664578 0.86 KIT (0.76) KITAKT1PDGFRBRPS6KB1
SCHEMBL15664342 0.86 KIT (0.77) KITAKT1PDGFRBPDGFRAGOT1

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 7 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
EP-2892534-A2 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR Plexxikon, Inc. (US) 2015-07-15 EP 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
WO-2014039714-A2 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. (US) 2014-03-13 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 (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 1/4885AKT1 40/4885PDGFRB 376/4885
US-20140128390-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR KIT, PRKCH, PRKACA KIT 1/4885AKT1 40/4885PDGFRB 376/4885

“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.