SCHEMBL22158306

SCHEMBL22158306

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1cc(-c2cc(F)cc(F)c2)cc(-n2c3ccccc3c3cc(C(C)(C)C)ccc32)c1C#N

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.34
RORC P51449 2/20 0.33
PGR P06401 1/20 0.33
RORA P35398 1/20 0.33
RORB Q92753 1/20 0.33
KIF11 P52732 4/20 0.33
KCNH2 Q12809 1/20 0.32
EGFR P00533 1/20 0.32
SRC P12931 1/20 0.32
SQOR Q9Y6N5 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
CASP1 P29466 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NRP1 O14786 1/20 0.31
CYP11B2 P19099 2/20 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
SCHEMBL22158353 0.94 KIF11 (0.36) KIF11EGFRSRCSQORNRP1
SCHEMBL22156390 0.94 KCNH2 (0.35) ARPGRKIF11KCNH2SQOR
SCHEMBL22157073 0.92 ADORA1 (0.36) ARRORCPGRRORARORB
SCHEMBL22157000 0.92 SQOR (0.37) ARRORCPGRRORARORB
SCHEMBL23348444 0.92 KCNH2 (0.32) KIF11KCNH2
SCHEMBL22157102 0.90 KIF11 (0.33) ARRORCPGRRORARORB
SCHEMBL22156862 0.90 RAPGEF3 (0.34) ARRORCPGRRORARORB
SCHEMBL23348416 0.89 PGR (0.35) PGRKIF11SQOR
SCHEMBL22158296 0.88 KDM4E (0.38) PGREGFRSRCSQORKDM4E
SCHEMBL22158446 0.87 RORC (0.33) ARRORCPGRRORARORB

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
EP-3635070-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-04-28 EP disclosed
US-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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 (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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 AR 3782/4885RORC 869/4885PGR 2348/4885

“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.