SCHEMBL22985476

SCHEMBL22985476

N#Cc1cc(C#N)cc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc(C#N)cc3C(F)(F)F)c(-c3cc(C#N)ccc3-n3c4ccccc4c4cc(-c5cc(C#N)cc(C#N)c5)ccc43)c2)c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.32
KIF11 P52732 1/20 0.32
PDPK1 O15530 1/20 0.32
AR P10275 5/20 0.32
PDK2 Q15119 2/20 0.31
PTGER4 P35408 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
SCHEMBL22985217 0.95 KIF11 (0.34) PGRKIF11AR
SCHEMBL20848512 0.95 KIF11 (0.31) PGRKIF11PDPK1
SCHEMBL22985122 0.94 PDK2 (0.37) KIF11PDPK1ARPDK2PTGER4
SCHEMBL22985029 0.94 KIF11 (0.37) PGRKIF11PDPK1ARPDK2
SCHEMBL22985160 0.94 KIF11 (0.34) KIF11PDPK1ARPDK2PTGER4
SCHEMBL22985480 0.93 KIF11 (0.31) KIF11PDPK1AR
SCHEMBL22985700 0.92 PTGER4 (0.33) KIF11PDPK1ARPTGER4
SCHEMBL24370448 0.92 KIF11 (0.33) PGRKIF11PDPK1ARPDK2
SCHEMBL22985295 0.92 AR (0.35) PDPK1ARPDK2
SCHEMBL22985293 0.92 AR (0.35) PDPK1ARPDK2

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 PGR 3779/4885KIF11 525/4885PDPK1 2545/4885

“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.