SCHEMBL22985340

SCHEMBL22985340

N#Cc1cc(C#N)c(-c2ccc3c(c2)c2cc(-c4c(C#N)cc(C#N)cc4C#N)ccc2n3-c2cc(C#N)ccc2-c2ccc(-c3ccc(C#N)cc3C(F)(F)F)cc2-n2c3ccc(-c4c(C#N)cc(C#N)cc4C#N)cc3c3cc(-c4c(C#N)cc(C#N)cc4C#N)ccc32)c(C#N)c1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 13/20 0.38
KIF11 P52732 2/20 0.34
PGR P06401 2/20 0.33
TRPV4 Q9HBA0 1/20 0.33
NSD2 O96028 1/20 0.32
XDH P47989 1/20 0.31
SLC22A12 Q96S37 1/20 0.31
KDM1A O60341 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
SCHEMBL22985237 0.96 AR (0.36) ARKIF11PGRTRPV4NSD2
SCHEMBL22985578 0.96 AR (0.36) ARKIF11PGRTRPV4NSD2
SCHEMBL22985251 0.95 AR (0.39) ARKIF11PGR
SCHEMBL22985255 0.94 AR (0.39) ARKIF11PGRTRPV4NSD2
SCHEMBL22985021 0.92 AR (0.38) ARKIF11PGRTRPV4NSD2
SCHEMBL22985006 0.91 AR (0.38) ARKIF11PGR
SCHEMBL22985020 0.91 AR (0.38) ARKIF11PGR
SCHEMBL20849430 0.91 AR (0.38) ARKIF11PGRTRPV4SLC22A12
SCHEMBL20848731 0.90 AR (0.34) ARKIF11PGRKDM1A
SCHEMBL20848505 0.90 AR (0.34) ARKIF11PGRKDM1A

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 3541/4885KIF11 525/4885PGR 3779/4885

“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.