SCHEMBL22985058

SCHEMBL22985058

Cc1cc(C)c(-c2ccc3c(c2)c2ccccc2n3-c2cc(C#N)ccc2-c2ccc(-c3ccc(C(F)(F)F)cc3C#N)cc2-n2c3ccccc3c3cc(-c4c(C)cc(C)cc4C)ccc32)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
AR P10275 2/20 0.34
XDH P47989 2/20 0.33
PTGER4 P35408 1/20 0.33
KIF11 P52732 2/20 0.32
MAT2A P31153 1/20 0.32
ELANE P08246 2/20 0.32
NR3C1 P04150 1/20 0.31
PGR P06401 1/20 0.31
NR3C2 P08235 1/20 0.31
PTGDR2 Q9Y5Y4 2/20 0.30
BCAT1 P54687 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
SCHEMBL22985351 0.97 ALOX5AP (0.35) ALOX5APFEN1ARXDHPTGER4
SCHEMBL22985059 0.96 ALOX5AP (0.39) ALOX5APFEN1ARXDHKIF11
SCHEMBL22985499 0.94 ALOX5AP (0.34) ALOX5APFEN1ARXDHPTGER4
SCHEMBL22985484 0.93 ALOX5AP (0.36) ALOX5APFEN1ARXDHPTGER4
SCHEMBL22985496 0.92 ALOX5AP (0.38) ALOX5APFEN1ARXDHKIF11
SCHEMBL22985349 0.92 ALOX5AP (0.38) ALOX5APFEN1ARXDHKIF11
SCHEMBL20848725 0.91 AR (0.34) ALOX5APFEN1ARPTGER4KIF11
SCHEMBL22985660 0.91 AR (0.43) ALOX5APFEN1ARXDHPTGER4
SCHEMBL22985663 0.91 AR (0.37) ALOX5APFEN1ARXDHPTGER4
SCHEMBL21399542 0.91 KIF11 (0.34) PTGER4KIF11MAT2AELANEPTGDR2

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 2939/4885AR 3541/4885

“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.