SCHEMBL22156728

SCHEMBL22156728

Cc1ccc2c(c1)c1ccccc1n2-c1cc(C(F)(F)F)cc(-n2c3ccccc3c3cc(C)ccc32)c1-c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.39
▸ BCHE P06276 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ TACR1 P25103 2/20 0.33
▸ HSP90AA1 P07900 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ HRH1 P35367 1/20 0.32
▸ HTR6 P50406 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ RORA P35398 1/20 0.32
▸ RORC P51449 1/20 0.32
▸ RORB Q92753 1/20 0.32
▸ PTGDR2 Q9Y5Y4 5/20 0.31
▸ MAPT P10636 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ NPY5R Q15761 1/20 0.31
▸ PPARG P37231 1/20 0.30
▸ PPARA Q07869 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
SCHEMBL23299850 0.93 KIF11 (0.42) KIF11TACR1HSP90AA1MAPTLMNA
SCHEMBL22157688 0.89 KIF11 (0.38) KIF11BCHEACHETACR1HSP90AA1
SCHEMBL22156727 0.88 KIF11 (0.42) KIF11HSP90AA1PGRRORARORC
SCHEMBL22157614 0.87 KIF11 (0.38) KIF11TACR1HSP90AA1PPARGPPARA
SCHEMBL22157605 0.87 KIF11 (0.38) KIF11TACR1HSP90AA1PPARGPPARA
SCHEMBL22156729 0.85 KIF11 (0.35) KIF11HSP90AA1PTGDR2
SCHEMBL22157671 0.85 KIF11 (0.37) KIF11BCHEACHETACR1HSP90AA1
SCHEMBL22156730 0.84 KIF11 (0.47) KIF11HSP90AA1PGRRORARORC
SCHEMBL22157617 0.84 KIF11 (0.37) KIF11TACR1HSP90AA1
SCHEMBL22158535 0.83 KIF11 (0.36) KIF11BCHEACHETP53HRH1

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 4485/4885BCHE 3315/4885ACHE 3194/4885

“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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