SCHEMBL29324494

SCHEMBL29324494

Cn1nc(C=O)c2c(F)cc(F)cc21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.33
PDK2 Q15119 1/20 0.33
ERN1 O75460 1/20 0.33
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL613838 0.77 ADORA2A (0.45) PDK1PDK2KDM4EALDH1A1MAPT
SCHEMBL30480710 0.77 ADORA2A (0.45) PDK1PDK2KDM4EALDH1A1MAPT
SCHEMBL15902309 0.73 ALDH1A1 (0.44) KDM4EALDH1A1
SCHEMBL23872146 0.72 PDK1 (0.43) PDK1PDK2KDM4EALDH1A1MAPT
SCHEMBL29324350 0.72 PDK1 (0.43) PDK1PDK2KDM4EALDH1A1MAPT
SCHEMBL29324204 0.71 PDK1 (0.36) PDK1PDK2KDM4E
Lithium SCHEMBL31337094 0.71 PDK1 (0.43) PDK1PDK2KDM4EALDH1A1MAPT
SCHEMBL15902179 0.70 ALDH1A1 (0.51) KDM4EALDH1A1
SCHEMBL1163903 0.70 PDK1 (0.31) PDK1PDK2
Lithium Ion SCHEMBL23858712 0.70 PDK1 (0.42) PDK1PDK2KDM4EALDH1A1MAPT

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-20240228484-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-07-11 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-20240228484-A1 MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP PDK1 704/4885PDK2 1831/4885ERN1 4095/4885

“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.