SCHEMBL25839733

SCHEMBL25839733

CC(C)NC(=O)CCOCCCN=[N+]=[N-]

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
FAAH O00519 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CNR2 P34972 2/20 0.35
NLRP1 Q9C000 1/20 0.35
ALDH1A1 P00352 1/20 0.33
CNR1 P21554 1/20 0.33
ADRB2 P07550 2/20 0.32
ALOX5 P09917 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
SCHEMBL20952821 0.84 MEN1 (0.52) MEN1FAAHMAPK1KMT2AHPGD
SCHEMBL26869086 0.83 CNR2 (0.34) CNR2ALOX5
SCHEMBL30103426 0.81 FAAH (0.58) MEN1FAAHMAPK1KMT2AHPGD
SCHEMBL2120346 0.77 FAAH (0.61) MEN1FAAHMAPK1KMT2AHPGD
SCHEMBL22355749 0.76 FAAH (0.44) MEN1FAAHMAPK1KMT2AHPGD
SCHEMBL19369832 0.76 ALOX5 (0.34) ALDH1A1ALOX5
SCHEMBL21472808 0.76 MEN1 (0.46) MEN1FAAHMAPK1KMT2AHPGD
SCHEMBL19369584 0.76 ALOX5 (0.34) ALDH1A1ALOX5
SCHEMBL19369827 0.76 ALOX5 (0.34) ALDH1A1ALOX5
SCHEMBL19369833 0.76 ALOX5 (0.34) ALDH1A1ALOX5

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-20230226193-A1 LIPID CONJUGATES FOR THE DELIVERY OF THERAPEUTIC AGENTS Arrowhead Pharmaceuticals, Inc. 2023-07-20 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-20230226193-A1 LIPID CONJUGATES FOR THE DELIVERY OF THERAPEUTIC AGENTS CPT1B, MUSK, MYLK2 MEN1 4753/4885FAAH 2901/4885MAPK1 4206/4885

“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.