SCHEMBL27802474

SCHEMBL27802474

NC(=O)CCCC(Cl)(Cl)C(N)=O

nearest known ligand 0.30

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
FAAH O00519 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
SOAT1 P35610 1/20 0.30
ALOX15 P16050 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 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
SCHEMBL31390331 0.91 SOAT1 (0.36) KMT2AMEN1FAAHTP53CYP1A2
SCHEMBL9714224 0.91 SOAT1 (0.36) KMT2AMEN1FAAHTP53CYP1A2
SCHEMBL5962093 0.84 SMPD1 (0.32)
SCHEMBL28361463 0.78 FDPS (0.45) TP53ALOX15
SCHEMBL10667625 0.76 FDPS (0.47)
SCHEMBL8707561 0.75 FDPS (0.48)
SCHEMBL7617313 0.75 KMT2A (0.35) KMT2AMEN1FAAHTP53CYP1A2
SCHEMBL10500400 0.74 KMT2A (0.32) KMT2AMEN1FAAHTP53CYP1A2
SCHEMBL232206 0.72 KDM4E (0.36) KMT2AMEN1FAAHTP53CYP1A2
SCHEMBL27452644 0.72 KMT2A (0.35) KMT2AMEN1FAAHTP53CYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101715764-A Preventer of gray mold and sclerotinia of plants and preparation method thereof UNIV DALIAN 2010-06-02 CN claimed
CN-116904150-A Composite binder based on modified nano carbon grafted acrylic acid and preparation method and application thereof 东莞理工学院 2023-10-20 CN disclosed
CN-101715764-A Preventer of gray mold and sclerotinia of plants and preparation method thereof UNIV DALIAN 2010-06-02 CN disclosed