SCHEMBL5448283

SCHEMBL5448283

CC(C)(C)NC(=S)Nc1cccc(C(F)(F)F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 1.00
NPSR1 Q6W5P4 5/20 0.74
ALDH1A1 P00352 8/20 0.71
GAA P10253 7/20 0.71
MAPT P10636 7/20 0.71
TDP1 Q9NUW8 4/20 0.71
IDO1 P14902 1/20 0.68
HTT P42858 1/20 0.66
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
CYP2D6 P10635 1/20 0.64
CYP2C19 P33261 1/20 0.64
LMNA P02545 3/20 0.63
L3MBTL1 Q9Y468 3/20 0.63
KDM4E B2RXH2 2/20 0.62

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
SCHEMBL7175227 0.87 MAPT (0.86) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL22024982 0.86 SMN1; SMN2 (0.75) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL12412637 0.84 ALDH1A1 (0.76) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL12404443 0.83 SMN1; SMN2 (0.71) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL22567749 0.82 MAPT (0.78) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL22567938 0.82 MAPT (0.78) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL12347771 0.81 MAPT (0.69) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL22065211 0.81 MAPT (0.72) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL2467470 0.81 IDO1 (1.00) SMN1; SMN2NPSR1ALDH1A1GAAMAPT
SCHEMBL26491182 0.81 LMNA (0.71) SMN1; SMN2NPSR1ALDH1A1GAAMAPT

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-20070040151-A1 Two-component initiator system (amine-free) with very good storage stability and particular suitability for acid systems HERAEUS KULZER GMBH (DE) 2007-02-22 US disclosed