SCHEMBL22985657

SCHEMBL22985657

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1ccc(C#N)c(-c2cc(-c3ccc(C(F)(F)F)cc3C#N)ccc2-n2c3ccccc3c3cc(C(C)(C)C)ccc32)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.37
FEN1 P39748 1/20 0.37
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
AR P10275 11/20 0.34
KIF11 P52732 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
NR3C1 P04150 1/20 0.32
XDH P47989 1/20 0.32
RORC P51449 1/20 0.32
PGR P06401 2/20 0.31
PTPN5 P54829 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
SCHEMBL22985421 0.96 ALOX5AP (0.39) ALOX5APFEN1PPARGPPARAAR
SCHEMBL22985652 0.95 ALOX5AP (0.40) ALOX5APFEN1PPARGARKIF11
SCHEMBL22985416 0.94 ALOX5AP (0.39) ALOX5APFEN1PPARGPPARAAR
SCHEMBL22985412 0.94 ALOX5AP (0.39) ALOX5APFEN1PPARGPPARAAR
SCHEMBL20849527 0.93 AR (0.38) PPARGPPARAARKIF11NR3C1
SCHEMBL22985206 0.93 ALOX5AP (0.38) ALOX5APFEN1ARKIF11GABRA1
SCHEMBL22985654 0.92 ALOX5AP (0.36) ALOX5APFEN1ARKIF11GABRA1
SCHEMBL22985263 0.92 ALOX5AP (0.42) ALOX5APFEN1ARNR3C1XDH
SCHEMBL22985414 0.91 ALOX5AP (0.37) ALOX5APFEN1ARKIF11GABRA1
SCHEMBL22985417 0.91 ALOX5AP (0.37) ALOX5APFEN1ARKIF11GABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919880-B2 Organic molecules, in particular for use in optoelectronic devices CYNORA GMBH (DE) 2021-02-16 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-10919880-B2 Organic molecules, in particular for use in optoelectronic devices OCIAD1, OCIAD2, POU2F1 ALOX5AP 2567/4885FEN1 2939/4885PPARG 326/4885

“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.