SCHEMBL22158455

SCHEMBL22158455

CC(C)(C)c1ccc2c3ccccc3n(-c3cc(-c4ccc(F)c(F)c4)cc(-n4c5ccccc5c5ccc(C(C)(C)C)cc54)c3C#N)c2c1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.34
NRP1 O14786 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 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
SCHEMBL22158456 0.95 RORC (0.32) KIF11NRP1
SCHEMBL22158457 0.94 KIF11 (0.33) KIF11ESR1ESR2
SCHEMBL22156854 0.91 KIF11 (0.35) KIF11
SCHEMBL22156533 0.89 KIF11 (0.34) KIF11ESR1ESR2
SCHEMBL22158353 0.88 KIF11 (0.36) KIF11NRP1
SCHEMBL22157070 0.87 ADORA2B (0.35) KIF11NRP1
SCHEMBL22157059 0.86 KIF11 (0.33) KIF11NRP1
SCHEMBL22156440 0.86 KIF11 (0.34) KIF11NRP1
SCHEMBL22157930 0.86 KIF11 (0.41) KIF11
SCHEMBL22156862 0.86 RAPGEF3 (0.34) KIF11NRP1

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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 KIF11 4485/4885NRP1 3132/4885ESR1 1322/4885

“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.