SCHEMBL8366203

SCHEMBL8366203

C=CC(=O)CCCC(N)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
BLM P54132 1/20 0.38
SLC6A3 Q01959 1/20 0.38
MEN1 O00255 1/20 0.38
CYP2D6 P10635 1/20 0.38
NFKB1 P19838 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 3/20 0.36
ENPEP Q07075 3/20 0.33
FGFR4 P22455 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
MAPT P10636 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
SCHEMBL8366797 0.86
SCHEMBL10664837 0.81 TSHR (0.36) TSHRSLC6A2SLC6A4BLMSLC6A3
SCHEMBL11869933 0.78 ALDH1A1 (0.42) TSHRMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6762246 0.76 TSHR (0.42) TSHRBLMMEN1KMT2AALDH1A1
SCHEMBL1988202 0.75 ALDH1A1 (0.50) TSHRALDH1A1FGFR4SMN1; SMN2MAPT
SCHEMBL6557587 0.75 ALDH1A1 (0.50) TSHRNFKB1ALDH1A1FGFR4SMN1; SMN2
SCHEMBL11662426 0.75 TSHR (0.43) TSHRNFKB1ALDH1A1SMN1; SMN2MAPT
SCHEMBL2911988 0.74
SCHEMBL28987308 0.74 GSR (0.53) TSHRBLMNFKB1CYP2C19KMT2A
SCHEMBL10657947 0.74 GSR (0.35) TSHRSLC6A2SLC6A4BLMSLC6A3

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
EP-0856015-B1 NEW POLYACRYLAMIDE MATRICES IN ELECTROPHORETIC AND CHROMATOGRAPHIC TECHNIQUES RIGHETTI PIER GIORGIO (IT) 1999-12-08 EP claimed