SCHEMBL20849166

SCHEMBL20849166

N#Cc1cccc(-c2ccc3c(c2)c2cc(-c4cccc(C#N)c4)ccc2n3-c2ccc(-c3c(C(F)(F)F)cccc3C(F)(F)F)cc2-c2ccc(C#N)cc2-n2c3ccc(-c4cccc(C#N)c4)cc3c3cc(-c4cccc(C#N)c4)ccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.39
PTPN5 P54829 1/20 0.36
KIF11 P52732 1/20 0.36
MAT2A P31153 1/20 0.34
MAP4K4 O95819 1/20 0.34
AR P10275 4/20 0.33
ENPP1 P22413 1/20 0.33
PRF1 P14222 1/20 0.33
CHEK1 O14757 1/20 0.33
PGR P06401 3/20 0.33
ACP1 P24666 1/20 0.32
SYK P43405 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
SLC22A12 Q96S37 1/20 0.32

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
SCHEMBL20849453 0.96 PDK2 (0.39) PDK2PTPN5KIF11MAT2AMAP4K4
SCHEMBL20849631 0.96 PDK2 (0.39) PDK2PTPN5KIF11MAT2AMAP4K4
SCHEMBL20849096 0.96 PDK2 (0.40) PDK2PTPN5KIF11MAT2AMAP4K4
SCHEMBL20848556 0.95 KIF11 (0.38) PDK2PTPN5KIF11ARCHEK1
SCHEMBL20849288 0.95 KIF11 (0.35) PDK2PTPN5KIF11MAT2AAR
SCHEMBL20849427 0.95 KIF11 (0.41) PDK2PTPN5KIF11ARPRF1
SCHEMBL20849041 0.94 KIF11 (0.36) PDK2KIF11MAT2AARACP1
SCHEMBL20848546 0.92 KIF11 (0.36) PDK2PTPN5KIF11ARACP1
SCHEMBL20849447 0.92 AR (0.45) PDK2KIF11MAT2AARENPP1
SCHEMBL20849095 0.92 PDK2 (0.40) PDK2PTPN5KIF11MAT2AMAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10978646-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-13 US disclosed
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-28 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-10978646-B2 Organic molecules for use in optoelectronic devices OCIAD2, OCIAD1, POU2F1 PDK2 1574/4885PTPN5 4494/4885KIF11 419/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 PDK2 1574/4885PTPN5 4494/4885KIF11 419/4885

“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.