SCHEMBL22604309

SCHEMBL22604309

CCCCCCCCN1CCN(CCN(C)C)C1=O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.42
ACHE P22303 2/20 0.42
DNM1 Q05193 3/20 0.42
GBA1 P04062 2/20 0.40
ALOX5 P09917 2/20 0.38
PTGS1 P23219 3/20 0.38
PTGS2 P35354 3/20 0.38
MGLL Q99685 3/20 0.38
FAAH O00519 2/20 0.38
S1PR1 P21453 1/20 0.36
CYP1A1 P04798 2/20 0.36

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
SCHEMBL9769271 0.87 GBA1 (0.47) BCHEACHEGBA1ALOX5PTGS1
SCHEMBL31093244 0.87 GBA1 (0.47) BCHEACHEGBA1ALOX5PTGS1
SCHEMBL31093212 0.87 GBA1 (0.47) BCHEACHEGBA1ALOX5PTGS1
SCHEMBL9617015 0.87 GBA1 (0.47) BCHEACHEGBA1ALOX5PTGS1
SCHEMBL9769185 0.87 GBA1 (0.47) BCHEACHEGBA1ALOX5PTGS1
SCHEMBL4421172 0.85 GBA1 (0.44) BCHEACHEGBA1ALOX5PTGS1
SCHEMBL8392265 0.83 GBA1 (0.45) BCHEACHEGBA1ALOX5PTGS1
SCHEMBL20912198 0.82 KDM4E (0.39) BCHEACHE
SCHEMBL17836960 0.80 ALOX5 (0.47) BCHEACHEGBA1ALOX5PTGS1
SCHEMBL4424409 0.79 MEN1 (0.45) BCHEACHEGBA1ALOX5MGLL

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
US-11795169-B2 MAP4K4 inhibitors IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2023-10-24 US disclosed
US-20200339583-A1 MAP4K4 INHIBITORS IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2020-10-29 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 (2 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-20200339583-A1 MAP4K4 INHIBITORS MAP4K4, MAP4K2, MAP4K5 BCHE 4578/4885ACHE 4767/4885DNM1 1625/4885
US-11795169-B2 MAP4K4 inhibitors MAP4K4, MAP4K2, MAP4K5 BCHE 4578/4885ACHE 4767/4885DNM1 1625/4885

“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.