SCHEMBL24601746

SCHEMBL24601746

FC(F)(F)c1ccc2c3c4c5ccccc5n5c6cc(C(F)(F)F)ccc6c(c6c7ccccc7n(c2c1)c63)c45

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.57
MAT2A P31153 3/20 0.36
HSP90AA1 P07900 1/20 0.36
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
MAPT P10636 1/20 0.36
MAPK10 P53779 1/20 0.36
MPI P34949 2/20 0.35
PHOSPHO1 Q8TCT1 2/20 0.35
PMM2 O15305 1/20 0.35
ESR1 P03372 1/20 0.34
G6PD P11413 1/20 0.33
TLR9 Q9NR96 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
GPR3 P46089 1/20 0.33
PDE2A O00408 1/20 0.33
PDE10A Q9Y233 1/20 0.33

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
SCHEMBL22178496 0.90 KIF11 (0.49) KIF11HSP90AA1MAPTMAPK10MPI
SCHEMBL24601628 0.88 KIF11 (0.42) KIF11MAT2AHSP90AA1MAPTPKM
SCHEMBL22178867 0.83 KIF11 (0.44) KIF11MAPTMPIPHOSPHO1PMM2
SCHEMBL24601521 0.82 KIF11 (0.37) KIF11MAPT
SCHEMBL24601532 0.80 KIF11 (0.40) KIF11HSP90AA1MAPTG6PDTLR9
SCHEMBL24601517 0.80 ESR1 (0.41) KIF11MAPTESR1ALDH1A1
SCHEMBL21570098 0.78 KDM4E (0.43) MAPTALDH1A1GPR3
SCHEMBL24601756 0.77 ATM (0.47) MAT2ACDK4CCND1MAPTMPI
SCHEMBL24601540 0.75 ALDH1A1 (0.37) KIF11MAPTMPIPHOSPHO1PMM2
SCHEMBL24601344 0.75 ALDH1A1 (0.37) KIF11MAPTMPIPHOSPHO1PMM2

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 3347/4885MAT2A 3113/4885HSP90AA1 4441/4885

“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.