SCHEMBL12279552

SCHEMBL12279552

Cc1ncc(C)c(Nc2ccc(Cl)c(F)c2)n1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 2/20 0.52
STK17A Q9UEE5 3/20 0.46
AXL P30530 1/20 0.45
EGFR P00533 2/20 0.44
KDR P35968 2/20 0.44
BRD4 O60885 7/20 0.42
JAK1 P23458 1/20 0.42
JAK3 P52333 1/20 0.42
BRDT Q58F21 1/20 0.42
AURKA O14965 1/20 0.41
SYK P43405 1/20 0.41
BCDIN3D Q7Z5W3 1/20 0.39

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
SCHEMBL264236 0.89 RAPGEF4 (0.52) RAPGEF4STK17AAXLEGFRKDR
SCHEMBL12279058 0.87 GRM4 (0.48) STK17AAXLEGFRKDRBRD4
SCHEMBL12279148 0.87 STK17A (0.53) RAPGEF4STK17AAXLEGFRKDR
SCHEMBL17915940 0.85 STK17A (0.51) RAPGEF4STK17AAXLBRD4JAK1
SCHEMBL270203 0.82 BRD4 (0.49) RAPGEF4STK17AAXLBRD4JAK1
SCHEMBL303841 0.82 BCL6 (0.60) RAPGEF4STK17AAXLBRD4JAK1
SCHEMBL12279478 0.81 BRD4 (0.59) EGFRKDRBRD4JAK1JAK3
SCHEMBL12279725 0.79 STK17A (0.52) STK17AEGFRKDRBRD4AURKA
SCHEMBL12279486 0.78 PIK3CA (0.52) EGFRKDRBRD4JAK1JAK3
SCHEMBL12813342 0.77 STK17A (0.57) RAPGEF4STK17AAXLEGFRKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 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 (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-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 RAPGEF4 2982/4885STK17A 243/4885AXL 267/4885

“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.