SCHEMBL22984983

SCHEMBL22984983

N#Cc1ccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c(-c2cc(-c3ccc(C#N)cc3C(F)(F)F)ccc2-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.40
AR P10275 8/20 0.38
PDK2 Q15119 2/20 0.37
PTPN5 P54829 1/20 0.35
PGR P06401 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
TRPV4 Q9HBA0 1/20 0.33
XDH P47989 2/20 0.33
SLC22A12 Q96S37 2/20 0.33
RORC P51449 1/20 0.33
NSD2 O96028 1/20 0.32

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
SCHEMBL22984999 0.97 KIF11 (0.38) KIF11ARPDK2PTPN5PGR
SCHEMBL22985057 0.96 KIF11 (0.38) KIF11ARPDK2PTPN5PGR
SCHEMBL22985594 0.96 KIF11 (0.38) KIF11ARPDK2PTPN5PGR
SCHEMBL22985015 0.94 KIF11 (0.45) KIF11ARPDK2PGRTRPV4
SCHEMBL20848902 0.94 KIF11 (0.39) KIF11ARPDK2PTPN5GABRA1
SCHEMBL24369956 0.94 KIF11 (0.37) KIF11ARPDK2PTPN5PGR
SCHEMBL22985410 0.94 KIF11 (0.41) KIF11ARPDK2PTPN5PGR
SCHEMBL22985254 0.94 PDK2 (0.40) KIF11ARPDK2PTPN5PGR
SCHEMBL22985553 0.93 KIF11 (0.36) KIF11ARPDK2PTPN5PGR
SCHEMBL22985582 0.93 KIF11 (0.36) KIF11ARPDK2PTPN5PGR

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 KIF11 525/4885AR 3541/4885PDK2 764/4885

“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.