SCHEMBL10445871

SCHEMBL10445871

C=C(COC(=O)NCl)S(=O)(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 2/20 0.42
ATM Q13315 1/20 0.38
HTT P42858 3/20 0.38
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA12 O43570 2/20 0.34
CA9 Q16790 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
TP53 P04637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33

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
SCHEMBL8914936 0.83 ALDH1A1 (0.44) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL8916021 0.81 ALDH1A1 (0.51) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL9077494 0.71 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL6627278 0.69 ALDH1A1 (0.44) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL16015553 0.68 PSIP1 (0.50) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL30116374 0.68 SMN1; SMN2 (0.43) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL11125588 0.68 SMN1; SMN2 (0.43) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL10599045 0.66 SMN1; SMN2 (0.55) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL1396567 0.65 SMN1; SMN2 (0.48) ALDH1A1LMNASMN1; SMN2MAPTATM
SCHEMBL6567521 0.64 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2MAPTHTT

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-0401817-A2 Reagents for rapid peptide synthesis RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1990-12-12 EP disclosed