SCHEMBL22822272

SCHEMBL22822272

Cn1c2ccccc2c2c1ccc1c3ccccc3n(-c3cc(-c4cc(C#N)cc(C(F)(F)F)c4)c(-n4c5ccccc5c5ccc6c(c7ccccc7n6C)c54)cc3C#N)c12

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.41
▸ RXRA P19793 1/20 0.31
▸ RXRG P48443 1/20 0.31
▸ XDH P47989 1/20 0.31
▸ NPY5R Q15761 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
SCHEMBL22822547 0.94 KIF11 (0.41) KIF11RXRARXRGXDHNPY5R
SCHEMBL22822273 0.91 KIF11 (0.41) KIF11RXRARXRGXDH
SCHEMBL20617402 0.89 RXRA (0.33) RXRARXRGXDH
SCHEMBL20617407 0.89 KIF11 (0.32) KIF11RXRARXRG
SCHEMBL22564577 0.87 KIF11 (0.44) KIF11RXRARXRGXDHNPY5R
SCHEMBL21738519 0.86 KIF11 (0.38) KIF11
SCHEMBL20617093 0.86 KIF11 (0.43) KIF11RXRARXRGXDHNPY5R
SCHEMBL22564419 0.86 KIF11 (0.39) KIF11RXRARXRG
SCHEMBL22822658 0.85 KIF11 (0.41) KIF11RXRARXRGXDH
SCHEMBL20617401 0.84 RXRA (0.36) KIF11RXRARXRGXDH

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
US-11021473-B2 Organic molecules for use in organic optoelectronic devices CYNORA GMBH (DE) 2021-06-01 — — US disclosed
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-24 — — 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 (2 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-11021473-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OCIAD2 KIF11 2841/4885RXRA 3552/4885RXRG 3138/4885
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 KIF11 4320/4885RXRA 3876/4885RXRG 3543/4885

“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.

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