SCHEMBL8600902

SCHEMBL8600902

C=C(C)C(=O)NCC.C=CCNCC=C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.37
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 1/20 0.35
TGFBR1 P36897 1/20 0.35
KMT2A Q03164 1/20 0.33
PLAAT3 P53816 1/20 0.33
PLAAT5 Q96KN8 1/20 0.33
PLAAT2 Q9NWW9 1/20 0.33
PLAAT4 Q9UL19 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.31
PKM P14618 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
SCHEMBL8032280 0.88 TSHR (0.42) FAAHTSHRSMN1; SMN2MAPTTGFBR1
SCHEMBL8530629 0.85 FAAH (0.39) FAAHTSHRSMN1; SMN2MAPTKMT2A
SCHEMBL14949 0.83
Diethylamine SCHEMBL721502 0.81 TGFBR1 (0.41) FAAHTGFBR1KMT2APLAAT3PLAAT5
SCHEMBL30604 0.81
Hydrochloric Acid SCHEMBL15846120 0.81
Ammonia Solution, Strong SCHEMBL7047319 0.81
Potassium SCHEMBL3659436 0.81
SCHEMBL18579931 0.81 SMN1; SMN2 (0.35) FAAHTSHRSMN1; SMN2MAPTTGFBR1
Hydrochloric Acid SCHEMBL10610285 0.79 TSHR (0.45) FAAHTSHRSMN1; SMN2MAPTTGFBR1

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
US-5830447-A BLEND OF COPOLYMER AND VOLATILE, HYDROPHOBIC SOLVENT THE PROCTER & GAMBLE COMPANY (US) 1998-11-03 US claimed