SCHEMBL24533909

SCHEMBL24533909

Cc1c(C#N)ncnc1C#N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 2/20 0.36
ALDH1A1 P00352 5/20 0.32
KDM4E B2RXH2 3/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CHEK1 O14757 1/20 0.31
ABL1 P00519 1/20 0.31
PDGFRB P09619 1/20 0.31
PDGFRA P16234 1/20 0.31
FLT1 P17948 1/20 0.31
GRK5 P34947 1/20 0.31
KDR P35968 1/20 0.31
MAP2K2 P36507 1/20 0.31
CDK8 P49336 1/20 0.31
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
PRKX P51817 1/20 0.31
NEK2 P51955 1/20 0.31
LIMK1 P53667 1/20 0.31
MAP2K1 Q02750 1/20 0.31
PRKCQ Q04759 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
SCHEMBL23942195 0.87 ERBB2 (0.33) ERBB2
SCHEMBL23264385 0.77 PKM (0.36)
SCHEMBL601225 0.76 ERBB2 (0.51) ERBB2ALDH1A1KDM4ECHEK1ABL1
SCHEMBL1997754 0.74 LRRK2 (0.34) ERBB2ALDH1A1KDM4EL3MBTL1DYRK1A
SCHEMBL15666218 0.74 ERBB2 (0.32) ERBB2DYRK1A
SCHEMBL19254039 0.74 LRRK2 (0.33) ERBB2ALDH1A1KDM4EL3MBTL1DYRK1A
SCHEMBL30675584 0.72 PIK3CD (0.40) ALDH1A1KDM4EPOLB
SCHEMBL20679571 0.72 PIK3CD (0.40) ALDH1A1KDM4EPOLB
SCHEMBL13480742 0.72 CCR1 (0.38) ALDH1A1KDM4EPOLB
SCHEMBL29207909 0.71 USP8 (0.33) ERBB2ALDH1A1KDM4ELMNAGAA

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-20220194974-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-06-23 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-20220194974-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OTC ERBB2 4250/4885ALDH1A1 402/4885KDM4E 1544/4885

“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.