SCHEMBL20848556

SCHEMBL20848556

N#Cc1ccc(-c2cc(-c3c(C(F)(F)F)cccc3C(F)(F)F)ccc2-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.38
PDK2 Q15119 2/20 0.36
PTPN5 P54829 1/20 0.35
AR P10275 7/20 0.34
ACP1 P24666 1/20 0.34
SLC22A12 Q96S37 1/20 0.32
SYK P43405 1/20 0.31
PGR P06401 1/20 0.31
ACLY P53396 1/20 0.31
MCHR1 Q99705 1/20 0.31
CHEK1 O14757 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
SCHEMBL20848546 0.97 KIF11 (0.36) KIF11PDK2PTPN5ARACP1
SCHEMBL20849370 0.96 KIF11 (0.38) KIF11PDK2PTPN5ARACP1
SCHEMBL20849427 0.96 KIF11 (0.41) KIF11PDK2PTPN5ARACP1
SCHEMBL20848909 0.96 KIF11 (0.39) KIF11PDK2PTPN5ARACP1
SCHEMBL20849166 0.95 PDK2 (0.39) KIF11PDK2PTPN5ARACP1
SCHEMBL20849638 0.95 KIF11 (0.40) KIF11PDK2PTPN5ARACP1
SCHEMBL20849172 0.94 KIF11 (0.39) KIF11PDK2PTPN5ARACP1
SCHEMBL20849194 0.93 KIF11 (0.36) KIF11PDK2PTPN5ARACP1
SCHEMBL20849453 0.93 PDK2 (0.39) KIF11PDK2PTPN5ARACP1
SCHEMBL20848914 0.93 KIF11 (0.37) KIF11PDK2PTPN5ARACP1

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 KIF11 419/4885PDK2 1574/4885PTPN5 4494/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 KIF11 419/4885PDK2 1574/4885PTPN5 4494/4885

“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.