SCHEMBL22985018

SCHEMBL22985018

N#Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4C#N)ccc2n3-c2ccc(C#N)cc2-c2ccc(-c3ccc(C#N)cc3C(F)(F)F)cc2-n2c3ccc(-c4ccc(C#N)cc4C#N)cc3c3cc(-c4ccc(C#N)cc4C#N)ccc32)c(C#N)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 12/20 0.38
STS P08842 1/20 0.34
KIF11 P52732 1/20 0.34
PGR P06401 2/20 0.33
TRPV4 Q9HBA0 1/20 0.33
NSD2 O96028 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 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
SCHEMBL22985270 0.96 AR (0.38) ARSTSKIF11PGRTRPV4
SCHEMBL22985255 0.96 AR (0.39) ARSTSKIF11PGRTRPV4
SCHEMBL22985017 0.96 AR (0.39) ARSTSKIF11PGRTRPV4
SCHEMBL22985397 0.95 AR (0.39) ARSTSKIF11PGR
SCHEMBL20848449 0.94 ALOX5AP (0.38) ARSTSKIF11PGRNSD2
SCHEMBL22985237 0.94 AR (0.36) ARKIF11PGRTRPV4NSD2
SCHEMBL22985384 0.93 AR (0.43) ARPGRALOX5APFEN1
SCHEMBL22985370 0.92 KIF11 (0.37) ARKIF11PGRTRPV4NSD2
SCHEMBL22985133 0.92 ALOX5AP (0.40) ARSTSKIF11PGRNSD2
SCHEMBL22985398 0.91 KIF11 (0.43) ARKIF11PGRTRPV4NSD2

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 3541/4885STS 2865/4885KIF11 525/4885

“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.