SCHEMBL7654081

SCHEMBL7654081

NC[C@H](NS(=O)(=O)c1cccs1)C(=O)OC(=O)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.45
SLC1A2 P43004 1/20 0.45
SLC1A1 P43005 1/20 0.45
TSHR P16473 2/20 0.43
TP53 P04637 3/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 1/20 0.41
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
LMNA P02545 2/20 0.39
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
RORA P35398 1/20 0.39
RORC P51449 1/20 0.39

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
Trifluoroacetic Acid SCHEMBL7654076 0.82 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1TSHRTP53
SCHEMBL7653133 0.77 SLC1A3 (0.44) SLC1A3SLC1A2SLC1A1ALDH1A1SMN1; SMN2
SCHEMBL7656972 0.75 MMP7 (0.55) SLC1A3SLC1A2MEN1KMT2AITGB3
SCHEMBL2655271 0.72 MEN1 (0.49) SLC1A3SLC1A2SLC1A1TSHRTP53
SCHEMBL7661156 0.71
SCHEMBL7661320 0.70 ALDH1A1 (0.42) MAPTALDH1A1HTTMEN1KMT2A
SCHEMBL7656995 0.69 ITGB3 (0.39) ITGB3ITGA2B
SCHEMBL7661122 0.68 NR3C2 (0.40) TSHRALDH1A1MEN1KMT2AITGB3
SCHEMBL6589504 0.68 SLC1A3 (0.54) SLC1A3SLC1A2SLC1A1TSHRTP53
SCHEMBL2200877 0.67 KMT2A (0.53) SLC1A3SLC1A2SLC1A1TSHRTP53

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-6335337-B1 ANTICOAGULANTS LABORATOIRE L. LAFON (FR) 2002-01-01 US disclosed