SCHEMBL22985160

SCHEMBL22985160

N#Cc1ccc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c(-c2cc(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)ccc2-c2ccc(C#N)cc2C(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.34
PDK2 Q15119 2/20 0.32
AR P10275 8/20 0.32
PDPK1 O15530 1/20 0.32
TSPO P30536 1/20 0.31
PTPN5 P54829 1/20 0.31
PTGER4 P35408 1/20 0.31
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
SCHEMBL22985029 0.97 KIF11 (0.37) KIF11PDK2ARPDPK1PTGER4
SCHEMBL22985162 0.97 KIF11 (0.36) KIF11PDK2ARPDPK1PTPN5
SCHEMBL22985122 0.95 PDK2 (0.37) KIF11PDK2ARPDPK1PTPN5
SCHEMBL20849190 0.95 KIF11 (0.33) KIF11PDK2ARPDPK1TSPO
SCHEMBL22985054 0.94 AR (0.36) KIF11PDK2ARPDPK1PTGER4
SCHEMBL22985476 0.94 PGR (0.32) KIF11PDK2ARPDPK1PTGER4
SCHEMBL24370445 0.93 KIF11 (0.38) KIF11PDK2ARPDPK1PTGER4
SCHEMBL22985027 0.92 KIF11 (0.41) KIF11PDK2ARPDPK1
SCHEMBL22985295 0.92 AR (0.35) PDK2ARPDPK1SCN9A
SCHEMBL22985293 0.92 AR (0.35) PDK2ARPDPK1SCN9A

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 525/4885PDK2 764/4885AR 3541/4885

“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.