SCHEMBL29069596

SCHEMBL29069596

CCC(N)C(C)CCCCCC(C)C(N)CC.NC(=O)CCCCCCCCCCC(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
SOAT1 P35610 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
FAAH O00519 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
LTA4H P09960 1/20 0.38
KDM4E B2RXH2 2/20 0.37
ALOX15 P16050 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35
FFAR1 O14842 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
TRPA1 O75762 1/20 0.34
SPHK1 Q9NYA1 2/20 0.34
CA1 P00915 1/20 0.34

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
SCHEMBL29069595 1.00 ALDH1A1 (0.46) ALDH1A1SOAT1KMT2AMEN1FAAH
SCHEMBL18123754 0.95 SOAT1 (0.49) ALDH1A1SOAT1KMT2AMEN1FAAH
SCHEMBL18123753 0.95 SOAT1 (0.49) ALDH1A1SOAT1KMT2AMEN1FAAH
Tetradecanamide SCHEMBL18123756 0.95 SOAT1 (0.49) ALDH1A1SOAT1KMT2AMEN1FAAH
SCHEMBL28662989 0.91 ALDH1A1 (0.49) ALDH1A1SOAT1KMT2AMEN1FAAH
SCHEMBL28673166 0.91 ALDH1A1 (0.49) ALDH1A1SOAT1KMT2AMEN1FAAH
SCHEMBL28352464 0.87 SOAT1 (0.49) ALDH1A1SOAT1KMT2AMEN1FAAH
Tetradecanamide SCHEMBL28615367 0.87 SOAT1 (0.49) ALDH1A1SOAT1KMT2AMEN1FAAH
SCHEMBL16711653 0.85 PAOX (0.42) ALDH1A1TP53LTA4HFFAR4FFAR1
SCHEMBL15167780 0.83 OPRM1 (0.42) ALDH1A1TP53CYP1A2CYP3A4KDM4E

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-114829504-B Glass fiber reinforced resin composition and glass fiber reinforced resin molded article 日东纺绩株式会社 2023-09-15 CN disclosed