SCHEMBL20617035

SCHEMBL20617035

N#Cc1cc(-c2cc(-n3c4ccccc4c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc43)c(C#N)cc2-n2c3ccccc3c3ccc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)cc32)cc(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.37
KIF11 P52732 2/20 0.34
PGR P06401 2/20 0.33
RXRA P19793 1/20 0.33
RXRG P48443 1/20 0.33
ALOX5AP P20292 2/20 0.32
FEN1 P39748 2/20 0.32
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
XDH P47989 2/20 0.31
CETP P11597 1/20 0.31
MAT2A P31153 1/20 0.31
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30
CYP2C9 P11712 1/20 0.30
SCN9A Q15858 1/20 0.30

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
SCHEMBL22822325 0.96 RXRA (0.35) ARKIF11PGRRXRARXRG
SCHEMBL19917928 0.95 AR (0.39) ARKIF11PGRALOX5APFEN1
SCHEMBL22822581 0.94 AR (0.37) ARKIF11PGRRXRARXRG
SCHEMBL20617036 0.94 AR (0.37) ARKIF11PGRRXRARXRG
SCHEMBL21546652 0.93 AR (0.37) ARKIF11PGREDNRBEDNRA
SCHEMBL19912447 0.92 AR (0.37) ARKIF11PGRALOX5APFEN1
SCHEMBL22822326 0.91 RXRA (0.35) ARKIF11PGRRXRARXRG
SCHEMBL21258678 0.91 AR (0.41) ARKIF11PGRALOX5APFEN1
SCHEMBL22564390 0.91 KIF11 (0.41) KIF11RXRARXRGXDHMAT2A
SCHEMBL20111602 0.90 KIF11 (0.34) ARKIF11PGRRXRARXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021473-B2 Organic molecules for use in organic optoelectronic devices CYNORA GMBH (DE) 2021-06-01 US disclosed
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-24 US disclosed
EP-3642302-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP disclosed
WO-2019001838-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-03 WO 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-11021473-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OCIAD2 AR 4374/4885KIF11 2841/4885PGR 3109/4885
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 AR 4325/4885KIF11 4320/4885PGR 3279/4885

“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.