SCHEMBL9901558

SCHEMBL9901558

Cc1c(C(N)=O)[se]c2ncnc(Nc3ccc(F)c(Cl)c3)c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.56
AURKA O14965 2/20 0.53
RPS6KB1 P23443 1/20 0.53
EGFR P00533 14/20 0.52
ERBB2 P04626 6/20 0.47
KDR P35968 4/20 0.45
GRM1 Q13255 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ERBB4 Q15303 1/20 0.45
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
INSR P06213 1/20 0.44
FBP1 P09467 1/20 0.44
PDGFRB P09619 1/20 0.44
FLT4 P35916 1/20 0.44
CLK1 P49759 1/20 0.44
EPHB4 P54760 1/20 0.44
TEK Q02763 1/20 0.44

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
SCHEMBL9901153 0.90 EGFR (0.50) DYRK1AAURKARPS6KB1EGFRERBB2
SCHEMBL16667301 0.86 DYRK1A (0.48) DYRK1AAURKARPS6KB1EGFRERBB2
SCHEMBL16667243 0.82 EGFR (0.47) DYRK1AAURKARPS6KB1EGFRERBB2
SCHEMBL15348704 0.74 EGFR (0.51) AURKARPS6KB1EGFRERBB2KDR
SCHEMBL9902301 0.73 EGFR (0.57) AURKARPS6KB1EGFRERBB2KDR
SCHEMBL16667191 0.72 EGFR (0.48) DYRK1AAURKARPS6KB1EGFRERBB2
SCHEMBL9901562 0.72 DYRK1A (0.61) DYRK1AAURKARPS6KB1EGFRERBB2
SCHEMBL16667189 0.72 AURKA (0.48) DYRK1AAURKARPS6KB1EGFRERBB2
SCHEMBL14733429 0.72 DYRK1A (1.00) DYRK1AEGFRERBB2
SCHEMBL17060609 0.72 DYRK1A (1.00) DYRK1AEGFRERBB2

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
EP-2648509-B1 SUBSTITUTED 4-(ARYLAMINO) SELENOPHENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LTD (IN) 2015-04-29 EP claimed
EP-2648509-A2 SUBSTITUTED 4-(ARYLAMINO) SELENOPHENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF Kasina Laila Innova Pharmaceuticals Private Ltd. (IN) 2013-10-16 EP claimed
WO-2012077135-A2 SUBSTITUTED 4-(ARYLAMINO) SELENOPHENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LIMITED (IN) 2012-06-14 WO claimed
US-9090633-B2 Substituted 4-(arylamino) selenophenopyrimidine compounds and methods of use thereof KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LIMITED (IN) 2015-07-28 US disclosed
EP-2648509-B1 SUBSTITUTED 4-(ARYLAMINO) SELENOPHENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LTD (IN) 2015-04-29 EP disclosed
US-20130287767-A1 SUBSTITUTED 4-(ARYLAMINO) SELENOPHENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LIMITED (IN) 2013-10-31 US disclosed
EP-2648509-A2 SUBSTITUTED 4-(ARYLAMINO) SELENOPHENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF Kasina Laila Innova Pharmaceuticals Private Ltd. (IN) 2013-10-16 EP disclosed
WO-2012077135-A2 SUBSTITUTED 4-(ARYLAMINO) SELENOPHENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LIMITED (IN) 2012-06-14 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 (1 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-20130287767-A1 SUBSTITUTED 4-(ARYLAMINO) SELENOPHENOPYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF SELENOI, VHL, DPYD DYRK1A 2910/4885AURKA 1612/4885RPS6KB1 3484/4885

“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.