SCHEMBL22930635

SCHEMBL22930635

CCCCCC(=O)[C@@H](N)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CES2 O00748 5/20 0.52
MEN1 O00255 1/20 0.48
FAAH O00519 1/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 1/20 0.48
CES1 P23141 4/20 0.46
AKR1B1 P15121 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL13934699 0.93 CES2 (0.44) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL13934948 0.93 CES2 (0.44) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL13934353 0.93 CES2 (0.44) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL5367731 0.85 CES2 (0.55) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL9617945 0.85 CES2 (0.55) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL12855284 0.84 SLC7A5 (0.46) CES2CES1
SCHEMBL29283929 0.83 CES2 (0.53) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL30989579 0.83 CES2 (0.53) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL30989581 0.83 CES2 (0.53) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL14396400 0.80 CES2 (0.59) CES2MEN1FAAHMAPK1KMT2A

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-10905683-B2 Compositions and uses of amidine derivatives BIOCRYST PHARMACEUTICALS, INC. (US) 2021-02-02 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-10905683-B2 Compositions and uses of amidine derivatives HRH3, HRH2, HRH1 CES2 999/4885MEN1 498/4885FAAH 275/4885

“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.