SCHEMBL24601745

SCHEMBL24601745

FC(F)(F)c1cccc2c3c4c5ccccc5n5c6c(C(F)(F)F)cccc6c(c6c7ccccc7n(c12)c63)c45

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.38
ESR1 P03372 3/20 0.35
HSD11B1 P28845 2/20 0.34
KDM4E B2RXH2 5/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HSD17B10 Q99714 1/20 0.33
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
MAPT P10636 1/20 0.32
POLB P06746 2/20 0.31
HTT P42858 2/20 0.31
LMNA P02545 1/20 0.31
PARP1 P09874 1/20 0.31
AXL P30530 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
SCHEMBL24601753 0.85 KIF11 (0.37) KIF11ESR1HSD11B1KDM4EALDH1A1
SCHEMBL24601755 0.77 KDM4E (0.34) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL21570098 0.74 KDM4E (0.43) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL24601434 0.74 PRKDC (0.35) KIF11KDM4EALDH1A1MAPT
SCHEMBL24601634 0.74 KIF11 (0.33) KIF11KDM4EALDH1A1HPGD
SCHEMBL24601439 0.73 KIF11 (0.33) KIF11KDM4EALDH1A1MAPT
SCHEMBL26261208 0.72 KDM4E (0.45) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL20857974 0.72 KDM4E (0.45) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL24601746 0.71 KIF11 (0.57) KIF11ESR1ALDH1A1MAPT
SCHEMBL22178496 0.71 KIF11 (0.49) KIF11ALDH1A1NR1H3MAPT

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-20220213113-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUNDS, FLUORESCENCE EMITTERS, ORGANIC ELECTROLUMINESCENT DEVICES, AND MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SAMSUNG ELECTRONICS CO., LTD. (KR) 2022-07-07 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-20220213113-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUNDS, FLUORESCENCE EMITTERS, ORGANIC ELECTROLUMINESCENT DEVICES, AND MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES NCL, NOC2L, NOLC1 KIF11 3347/4885ESR1 1037/4885HSD11B1 4868/4885

“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.