SCHEMBL22156735

SCHEMBL22156735

Fc1cc(F)cc(-c2c(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc(C(F)(F)F)cc2-n2c3ccc(-n4c5ccccc5c5ccccc54)cc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)c1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ ATM Q13315 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PPARG P37231 3/20 0.32
▸ PPARA Q07869 2/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ TACR1 P25103 2/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ NR3C1 P04150 1/20 0.31
▸ PGR P06401 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
SCHEMBL22156737 1.00 KIF11 (0.35) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL22157338 0.93 KIF11 (0.38) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL22156738 0.93 KIF11 (0.38) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL22157352 0.87 KIF11 (0.40) KIF11PPARGPPARAHSP90AA1TACR1
SCHEMBL22157671 0.87 KIF11 (0.37) KIF11HSP90AA1TACR1TDP1
SCHEMBL22157448 0.87 TACR1 (0.36) KIF11TACR1TDP1NR3C1PGR
SCHEMBL22157614 0.86 KIF11 (0.38) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL22157605 0.86 KIF11 (0.38) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL22158633 0.84 KIF11 (0.36) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL22156750 0.84 KIF11 (0.36) KIF11KDM4EATML3MBTL1PPARG

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 4485/4885KDM4E 4239/4885ATM 4062/4885

“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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