SCHEMBL27363357

SCHEMBL27363357

NCCCCCCOC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 5/20 0.33
ITGA2B P08514 5/20 0.33
ALOX12 P18054 1/20 0.33
PAOX Q6QHF9 2/20 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
SCHEMBL13748507 0.92 ALOX12 (0.38) ALOX12
SCHEMBL1949595 0.92 ALOX12 (0.38) ALOX12
SCHEMBL1280224 0.90 ALOX12 (0.37) ALOX12
SCHEMBL22919640 0.84 NAAA (0.44)
SCHEMBL7278773 0.84 NAAA (0.44)
SCHEMBL11998879 0.83 ALOX12 (0.35) ALOX12
SCHEMBL2037671 0.82 NAAA (0.42)
SCHEMBL4696869 0.82 ALDH1A1 (0.41) ALOX12
SCHEMBL18755724 0.81 ALOX12 (0.33) ALOX12
SCHEMBL13541624 0.80 ALDH1A1 (0.42)

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
WO-2024050440-A2 PROSTATE-SPECIFIC MEMBRANE ANTIGEN TARGETED DEEP-TUMOR PENETRATION OF POLYMER NANODRUGS AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-03-07 WO disclosed