SCHEMBL28158676

SCHEMBL28158676

CCCCCC=CC=CCOC(=O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.50
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
ALDH1A1 P00352 1/20 0.47
TSHR P16473 1/20 0.47
FAAH O00519 4/20 0.47
PPARG P37231 2/20 0.43
GPR132 Q9UNW8 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL11808432 0.88 FAAH (0.50) FAAHPPARGMEN1KMT2A
SCHEMBL11808420 0.88 FAAH (0.50) FAAHPPARGMEN1KMT2A
SCHEMBL21112081 0.82 FASN (0.53) FASNALDH1A1TSHRFAAHKDM4E
SCHEMBL21112082 0.82 FASN (0.53) FASNALDH1A1TSHRFAAHKDM4E
SCHEMBL7611682 0.82 FASN (0.53) FASNALDH1A1TSHRFAAHKDM4E
SCHEMBL2012252 0.81 FASN (0.53) FASNCNR1CNR2ALDH1A1TSHR
SCHEMBL3417127 0.81 CNR1 (0.50) FASNCNR1CNR2ALDH1A1TSHR
SCHEMBL3417129 0.81 CNR1 (0.50) FASNCNR1CNR2ALDH1A1TSHR
SCHEMBL11516599 0.81 FASN (0.51) FASNCNR1CNR2ALDH1A1TSHR
SCHEMBL7197131 0.81 FASN (0.56) FASNALDH1A1TSHRFAAHKDM4E

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-106999973-A System and method for discharging edible material 阿甘芳香和精细化工有限公司 2017-08-01 CN disclosed