SCHEMBL22822658

SCHEMBL22822658

Cn1c2ccccc2c2ccc3c4ccccc4n(-c4cc(C#N)c(-c5cc(C#N)cc(C(F)(F)F)c5)cc4-n4c5ccccc5c5ccc6c7ccccc7n(C)c6c54)c3c21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.41
▸ RXRA P19793 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ XDH P47989 4/20 0.33
▸ HSP90AA1 P07900 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ ALKBH5 Q6P6C2 1/20 0.32
▸ FTO Q9C0B1 1/20 0.32
▸ PDPK1 O15530 1/20 0.32
▸ IMPDH2 P12268 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ BRD4 O60885 2/20 0.31
▸ SLC22A12 Q96S37 1/20 0.30
▸ TAS2R14 Q9NYV8 1/20 0.30
▸ GPBAR1 Q8TDU6 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ METAP2 P50579 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
SCHEMBL22822273 0.94 KIF11 (0.41) KIF11RXRARXRGXDHHSP90AA1
SCHEMBL22822547 0.91 KIF11 (0.41) KIF11RXRARXRGXDH
SCHEMBL22822544 0.89 RXRA (0.36) KIF11RXRARXRGXDHPDPK1
SCHEMBL22564426 0.86 RXRA (0.35) KIF11RXRARXRGXDHPDPK1
SCHEMBL22564578 0.86 KIF11 (0.44) KIF11RXRARXRGXDHHSP90AA1
SCHEMBL22564564 0.86 KIF11 (0.41) KIF11RXRARXRGXDHPDPK1
SCHEMBL22822647 0.85 KIF11 (0.34) KIF11RXRARXRGXDHTAS2R14
SCHEMBL20617084 0.85 KIF11 (0.43) KIF11RXRARXRGXDHHSP90AA1
SCHEMBL22760810 0.85 ALKBH5 (0.37) HSP90AA1IDO1ALKBH5FTOIMPDH2
SCHEMBL22822682 0.84 RXRA (0.39) KIF11RXRARXRGXDHPDPK1

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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