SCHEMBL10889100

SCHEMBL10889100

COCCC(=O)N1C(=O)CCC1=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 3/20 0.42
HTT P42858 1/20 0.42
ALDH1A1 P00352 5/20 0.37
MAPT P10636 1/20 0.37
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.34
TGM2 P21980 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
APEX1 P27695 1/20 0.31
POLB P06746 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GAA P10253 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
SCHEMBL14275065 0.89 HPGD (0.43) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL20821713 0.83 HPGD (0.43) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL19432778 0.79 CYP2D6 (0.35) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL16203504 0.79 LMNA (0.39) LMNAPOLB
SCHEMBL22729318 0.78 TSHR (0.50) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL21162206 0.78 HPGD (0.39) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL12680023 0.78 TSHR (0.57) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL8178094 0.77 CES1 (0.43) SMN1; SMN2LMNAKMT2APOLB
SCHEMBL10044366 0.77 TSHR (0.64) SMN1; SMN2HPGDHTTALDH1A1MAPT
SCHEMBL29366012 0.76 LMNA (0.40) SMN1; SMN2HPGDHTTALDH1A1MAPT

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-4608420-A SELF-CURING OR CURING AGENTS FOR HYDROXY COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1986-08-26 US disclosed