SCHEMBL22985138

SCHEMBL22985138

N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)ccc32)c(-c2cc(-n3c4ccccc4c4cc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)ccc43)ccc2-c2ccc(C(F)(F)F)cc2C#N)c1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
PGR P06401 1/20 0.31
KIF11 P52732 1/20 0.30
CYP2C9 P11712 1/20 0.30
SCN9A Q15858 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
SCHEMBL20848492 0.95 ALOX5AP (0.33) ARALOX5APFEN1PGRKIF11
SCHEMBL20848951 0.95 AR (0.32) ARALOX5APFEN1KIF11CYP2C9
SCHEMBL22985211 0.94 ALOX5AP (0.36) ALOX5APFEN1KIF11
SCHEMBL22985482 0.94 AR (0.32) ARALOX5APFEN1KIF11CYP2C9
SCHEMBL20848906 0.93 AR (0.34) ARALOX5APFEN1PGRSCN9A
SCHEMBL22985172 0.92 ALOX5AP (0.35) ARALOX5APFEN1KIF11
SCHEMBL22985168 0.92 KIF11 (0.36) ARALOX5APFEN1PGRKIF11
SCHEMBL22985063 0.92 KIF11 (0.33) ARALOX5APFEN1KIF11
SCHEMBL22985345 0.91 ALOX5AP (0.37) ARALOX5APFEN1PGRKIF11
SCHEMBL22985070 0.91 ALOX5AP (0.38) ARALOX5APFEN1PGRKIF11

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 AR 3541/4885ALOX5AP 2567/4885FEN1 2939/4885

“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.