SCHEMBL22158353

SCHEMBL22158353

CC(C)(C)c1ccc2c3ccccc3n(-c3cc(-c4cc(F)cc(F)c4)cc(-n4c5ccccc5c5ccc(C(C)(C)C)cc54)c3C#N)c2c1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.36
EGFR P00533 1/20 0.31
SRC P12931 1/20 0.31
KCNJ5 P48544 1/20 0.31
KCNJ3 P48549 1/20 0.31
KCNQ1 P51787 1/20 0.31
CACNA1C Q13936 1/20 0.31
SQOR Q9Y6N5 1/20 0.31
NRP1 O14786 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
SCHEMBL22158306 0.94 AR (0.34) KIF11EGFRSRCSQORNRP1
SCHEMBL23348444 0.93 KCNH2 (0.32) KIF11
SCHEMBL22157070 0.92 ADORA2B (0.35) KIF11KCNJ5KCNJ3KCNQ1CACNA1C
SCHEMBL22157098 0.90 KIF11 (0.34) KIF11NRP1
SCHEMBL22156854 0.90 KIF11 (0.35) KIF11EGFRSRC
SCHEMBL22158330 0.89
SCHEMBL23348416 0.88 PGR (0.35) KIF11SQOR
SCHEMBL22156390 0.88 KCNH2 (0.35) KIF11SQOR
SCHEMBL22158455 0.88 KIF11 (0.34) KIF11NRP1
SCHEMBL19903690 0.88 KIF11 (0.43) KIF11EGFRSRC

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3635070-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-04-28 EP disclosed
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 4485/4885EGFR 1699/4885SRC 3157/4885

“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.