SCHEMBL22563391

SCHEMBL22563391

N#Cc1cc(-n2c3ccccc3c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)ccc32)c(-n2c3ccccc3c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)ccc32)cc1-c1nc(-c2ccccc2)cc(-c2ccccc2)n1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.36
FEN1 P39748 2/20 0.36
AR P10275 4/20 0.36
XDH P47989 2/20 0.35
KDM4E B2RXH2 5/20 0.34
ALDH1A1 P00352 3/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
HPGD P15428 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
GAA P10253 1/20 0.34
CYP2C9 P11712 1/20 0.33
SCN9A Q15858 1/20 0.33
TOP1 P11387 1/20 0.32
PGR P06401 1/20 0.32
CNR2 P34972 1/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL22563503 0.97 ALOX5AP (0.38) ALOX5APFEN1ARXDHKDM4E
SCHEMBL21278818 0.95 ALOX5AP (0.35) ALOX5APFEN1ARXDHKDM4E
SCHEMBL22563411 0.95 ALOX5AP (0.36) ALOX5APFEN1ARXDHKDM4E
SCHEMBL23487289 0.95 AR (0.36) ALOX5APFEN1ARXDHKDM4E
SCHEMBL19943088 0.94 AR (0.36) ALOX5APFEN1ARXDHCYP2C9
SCHEMBL19919797 0.93 ALOX5AP (0.36) ALOX5APFEN1ARXDHKDM4E
SCHEMBL21278875 0.92 ALOX5AP (0.37) ALOX5APFEN1ARXDHKDM4E
SCHEMBL21108055 0.91 AR (0.38) ALOX5APFEN1ARXDHCYP2C9
SCHEMBL22563397 0.91 KIF11 (0.35) ALOX5APFEN1XDHKDM4EALDH1A1
SCHEMBL22562606 0.90 CTSS (0.36) ALOX5APFEN1ARXDHKDM4E

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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 US disclosed
EP-3580300-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP 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 (1 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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 ALOX5AP 3140/4885FEN1 1753/4885AR 4552/4885

“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.