SCHEMBL8697207

SCHEMBL8697207

CCOC(=O)CC(=S)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.49
ALDH1A1 P00352 2/20 0.49
GAA P10253 4/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
NPC1 O15118 2/20 0.47
MAPT P10636 2/20 0.47
RAB9A P51151 2/20 0.46
PPID Q08752 1/20 0.46
POLB P06746 1/20 0.46
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL7873229 0.86 GAA (0.48) SMN1; SMN2ALDH1A1GAAMGAMSI
SCHEMBL8394622 0.83 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1GAAMGAMSI
SCHEMBL124577 0.81 KMT2A (0.59) SMN1; SMN2ALDH1A1GAAMGAMSI
SCHEMBL28897222 0.81 KMT2A (0.59) SMN1; SMN2ALDH1A1GAAKMT2AMAPT
SCHEMBL17433663 0.80 KMT2A (0.57) SMN1; SMN2ALDH1A1GAAMGAMSI
SCHEMBL31439645 0.80 KMT2A (0.57) SMN1; SMN2ALDH1A1GAAMGAMSI
SCHEMBL28792148 0.80 KMT2A (0.57) SMN1; SMN2ALDH1A1GAAMGAMSI
SCHEMBL17433641 0.80 KMT2A (0.57) SMN1; SMN2ALDH1A1GAAMGAMSI
SCHEMBL17433560 0.80 KMT2A (0.57) SMN1; SMN2ALDH1A1GAAMGAMSI
SCHEMBL6753757 0.80 KMT2A (0.57) SMN1; SMN2ALDH1A1GAAMGAMSI

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-5852028-A Pyrimidine carboxylates and related compounds and methods for treating inflammatory conditions SIGNAL PHARMACEUTICALS, INC. (US) 1998-12-22 US disclosed