SCHEMBL28298260

SCHEMBL28298260

CCCCCCCCCCCCCC/C(=C/C(=O)O)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
SOAT1 P35610 1/20 0.48
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 4/20 0.48
PTPN1 P18031 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48

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
SCHEMBL28054391 1.00 FAAH (0.49) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL28196445 1.00 FAAH (0.49) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL27564543 1.00 FAAH (0.49) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL28283297 1.00 FAAH (0.49) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL5176301 0.92 CES1 (0.41) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL5177367 0.92 CES1 (0.41) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL5176308 0.92 CES1 (0.41) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL5432088 0.86 FAAH (0.50) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL7562498 0.86 FAAH (0.50) FAAHMEN1KMT2ATP53CYP1A2
SCHEMBL7571413 0.86 FAAH (0.50) FAAHMEN1KMT2ATP53CYP1A2

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-109790401-A Method for producing an aqueous dispersion 巴斯夫欧洲公司 2019-05-21 CN disclosed