SCHEMBL25625876

SCHEMBL25625876

FC(F)(F)c1ccc2c(ccc3c4ccncc4ccc23)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.55
CHUK O15111 1/20 0.50
TRPV1 Q8NER1 10/20 0.44
BACE1 P56817 1/20 0.41
METAP2 P50579 1/20 0.41
EPHX2 P34913 1/20 0.40
KDM5A P29375 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39

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
SCHEMBL30356278 0.88 CHUK (0.55) KIF11CHUKTRPV1METAP2EPHX2
SCHEMBL12473661 0.83 BACE1 (0.48) KIF11BACE1METAP2
SCHEMBL12310186 0.83 BACE1 (0.48) KIF11BACE1METAP2
SCHEMBL12320899 0.83 BACE1 (0.48) KIF11BACE1METAP2
SCHEMBL25625862 0.83 TRPV1 (0.41) KIF11TRPV1GSK3AGSK3BCDK5
SCHEMBL31478776 0.82 KIF11 (0.49) KIF11CHUKBACE1METAP2
SCHEMBL9998096 0.82 KIF11 (0.49) KIF11CHUKBACE1METAP2
SCHEMBL11139756 0.82 KIF11 (0.49) KIF11CHUKBACE1METAP2
SCHEMBL29963616 0.82 KIF11 (0.49) KIF11CHUKBACE1METAP2
SCHEMBL12317668 0.79 BACE1 (0.46) KIF11BACE1METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192719-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT CANON KABUSHIKI KAISHA (JP) 2023-06-22 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-20230192719-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT OR10J3, CRY1, RPS19 KIF11 3790/4885CHUK 3067/4885TRPV1 1972/4885

“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.