SCHEMBL21035280

SCHEMBL21035280

Cc1ccc2nc3cc(N4CC(OS(C)(=O)=O)C4)ccn3c2c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
ALDH1A1 P00352 3/20 0.37
GAA P10253 2/20 0.37
LMNA P02545 1/20 0.37
IKBKB O14920 1/20 0.35
POLB P06746 4/20 0.34
TP53 P04637 3/20 0.34
RAB9A P51151 1/20 0.34
PIM1 P11309 1/20 0.33
PIM3 Q86V86 1/20 0.33
HRH4 Q9H3N8 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 2/20 0.31
KDM4E B2RXH2 2/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL18838768 0.89 CYP2D6 (0.40) MAPTALDH1A1GAALMNAIKBKB
SCHEMBL18838775 0.83 IKBKB (0.40) MAPTALDH1A1GAALMNAIKBKB
SCHEMBL18867172 0.81 MAPT (0.41) MAPTALDH1A1GAALMNAIKBKB
SCHEMBL31031239 0.81 CYP2D6 (0.44) MAPTALDH1A1GAALMNAIKBKB
SCHEMBL18838764 0.80 IKBKB (0.40) MAPTALDH1A1GAALMNAIKBKB
SCHEMBL22986624 0.80 IKBKB (0.42) MAPTALDH1A1GAALMNAIKBKB
SCHEMBL20515380 0.80 IKBKB (0.40) MAPTALDH1A1GAALMNAIKBKB
SCHEMBL22986638 0.77 IKBKB (0.38) MAPTALDH1A1GAALMNAIKBKB
SCHEMBL2162653 0.77 TLR9 (0.38) ALDH1A1KMT2AHSD17B10KDM4E
SCHEMBL31031243 0.76 KIT (0.38) PIM1

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-3374358-B1 AZETIDINE DERIVATIVES FOR TAU IMAGING LILLY CO ELI (US) 2021-02-17 EP disclosed
US-10301308-B2 Azetidine derivatives for tau imaging ELI LILLY AND COMPANY (US) 2019-05-28 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-10301308-B2 Azetidine derivatives for tau imaging MAPT, PSEN2, PSEN1 MAPT 1/4885ALDH1A1 4225/4885GAA 184/4885

“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.