SCHEMBL28047426

SCHEMBL28047426

COC(=O)C(CCCCCCCC(=O)O)C1CC(C)(C)N(C)CC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
PTGER4 P35408 1/20 0.31
PTGER3 P43115 1/20 0.31
PTGER2 P43116 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
FFAR1 O14842 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
SCHEMBL1562364 0.78 FFAR4 (0.37) ALDH1A1PTGER4PTGER3PTGER2FFAR4
SCHEMBL15135064 0.77 EPHX2 (0.33) ALDH1A1
SCHEMBL4421431 0.77 FFAR4 (0.31) ALDH1A1PTGER4PTGER3PTGER2FFAR4
SCHEMBL21629623 0.72 FFAR4 (0.36) ALDH1A1PTGER4PTGER3PTGER2FFAR4
SCHEMBL28131783 0.70 TP53 (0.40) ALDH1A1PTGER4PTGER3PTGER2FFAR4
SCHEMBL28047427 0.70 NAAA (0.36)
SCHEMBL28120626 0.70 CPN1 (0.34) PTGER4PTGER3PTGER2FFAR4FFAR1
SCHEMBL27839391 0.69 ALDH1A1 (0.35) ALDH1A1PTGER4PTGER3PTGER2FFAR4
SCHEMBL1897161 0.68 L3MBTL1 (0.39) ALDH1A1PTGER4PTGER3PTGER2
SCHEMBL1019749 0.67 FFAR4 (0.41) ALDH1A1PTGER4PTGER3PTGER2FFAR4

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
CN-105555545-A Heat transfer films for the dry coating of surfaces BASF SE 2016-05-04 CN disclosed