SCHEMBL22822657

SCHEMBL22822657

N#Cc1cc(-c2cc(-n3c4cc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)ccc4c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc43)c(-n3c4cc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)ccc4c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc43)cc2C#N)cc(C(F)(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.36
FEN1 P39748 2/20 0.36
RXRA P19793 1/20 0.36
RXRG P48443 1/20 0.36
AR P10275 6/20 0.36
KIF11 P52732 1/20 0.33
XDH P47989 3/20 0.33
PGR P06401 1/20 0.32
DGAT1 O75907 1/20 0.31
SOAT1 P35610 1/20 0.31
KCNH2 Q12809 1/20 0.31
MAT2A P31153 1/20 0.31
CETP P11597 1/20 0.31
HSD17B1 P14061 1/20 0.31
HSD17B2 P37059 1/20 0.31
CYP2C9 P11712 1/20 0.31
SCN9A Q15858 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL22822581 0.95 AR (0.37) ALOX5APFEN1RXRARXRGAR
SCHEMBL22822325 0.93 RXRA (0.35) ALOX5APFEN1RXRARXRGAR
SCHEMBL22822541 0.92 ALOX5AP (0.36) ALOX5APFEN1RXRARXRGAR
SCHEMBL22761038 0.91 PTGDR2 (0.39) ALOX5APFEN1ARXDHPGR
SCHEMBL19903555 0.90 AR (0.39) ALOX5APFEN1ARKIF11XDH
SCHEMBL20617035 0.90 AR (0.37) ALOX5APFEN1RXRARXRGAR
SCHEMBL22822582 0.90 AR (0.37) ALOX5APFEN1RXRARXRGAR
SCHEMBL22822145 0.90 RXRA (0.39) ALOX5APFEN1RXRARXRGKIF11
SCHEMBL20112006 0.89 ALOX5AP (0.35) ALOX5APFEN1RXRARXRGAR
SCHEMBL20617113 0.89 RXRA (0.38) ALOX5APFEN1RXRARXRGAR

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-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

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 ALOX5AP 2916/4885FEN1 1025/4885RXRA 3552/4885
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 ALOX5AP 2908/4885FEN1 1433/4885RXRA 3876/4885

“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.