SCHEMBL28196153

SCHEMBL28196153

C=C(C)C(=O)NOCC.C=CCNC(=O)C(=C)C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.37
KDM4E B2RXH2 2/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 7/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KMT2A Q03164 3/20 0.33
PKM P14618 1/20 0.33
THRB P10828 1/20 0.33
LMNA P02545 2/20 0.32
MEN1 O00255 2/20 0.32
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL2209427 0.84
SCHEMBL30604 0.84
Ammonia Solution, Strong SCHEMBL9663785 0.82 TSHR (0.45) FAAHKDM4ETSHRMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL10610285 0.82 TSHR (0.45) FAAHKDM4ETSHRMAPTSMN1; SMN2
Ammonia Solution, Strong SCHEMBL1326687 0.82 TSHR (0.45) FAAHKDM4ETSHRMAPTSMN1; SMN2
Dimethylamine SCHEMBL3953015 0.80 TSHR (0.43) FAAHKDM4ETSHRMAPTSMN1; SMN2
SCHEMBL28322674 0.78 TDP1 (0.50) KDM4EALDH1A1THRBLMNAALOX15
SCHEMBL8032280 0.78 TSHR (0.42) FAAHKDM4ETSHRMAPTSMN1; SMN2
SCHEMBL4843584 0.75 TSHR (0.45) FAAHKDM4ETSHRMAPTSMN1; SMN2
SCHEMBL28196154 0.75 TDP1 (0.31)

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-105264647-B Silicon Wafer composition for polishing 福吉米株式会社 2018-01-09 CN disclosed