SCHEMBL21116565

SCHEMBL21116565

N#Cc1ccc(-c2ccc3c4ccccc4n(-c4cc(-c5ccc(C(F)(F)F)c(-n6c7ccccc7c7ccc(-c8ccc(C#N)cc8C#N)cc76)c5)ccc4C(F)(F)F)c3c2)c(C#N)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 12/20 0.39
KIF11 P52732 1/20 0.38
PGR P06401 2/20 0.37
STS P08842 1/20 0.36
PDK2 Q15119 1/20 0.33
KDM1A O60341 1/20 0.33
SCN9A Q15858 1/20 0.33
PDPK1 O15530 1/20 0.33

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
SCHEMBL21116564 0.95 KIF11 (0.42) ARKIF11PGRSTSKDM1A
SCHEMBL21116566 0.94 AR (0.39) ARKIF11PGRSTSPDK2
SCHEMBL21116906 0.89 AR (0.45) ARPGR
SCHEMBL21116259 0.89 KIF11 (0.45) ARKIF11PGRPDK2PDPK1
SCHEMBL23798840 0.89 AR (0.39) ARKIF11PGRSTSKDM1A
SCHEMBL21131414 0.89 AR (0.41) ARKIF11PGRSTSSCN9A
SCHEMBL25659382 0.88 AR (0.39) ARKIF11PGRSTSPDPK1
SCHEMBL21116338 0.88 KIF11 (0.42) ARKIF11PGRSTSKDM1A
SCHEMBL21116487 0.88 KIF11 (0.50) ARKIF11PDK2PDPK1
SCHEMBL21547125 0.87 PDK2 (0.39) ARPGRSTSPDK2PDPK1

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-11136294-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-10-05 US disclosed
US-20190194130-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-06-27 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-20190194130-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, NOX3, ORC3 AR 1096/4885KIF11 3544/4885PGR 2665/4885
US-11136294-B2 Organic molecules for use in optoelectronic devices OR10J3, ORC3, NOX3 AR 1080/4885KIF11 3520/4885PGR 2701/4885

“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.