SCHEMBL8364692

SCHEMBL8364692

COC(=O)c1cc(-c2ccc(SC)cc2)n(Cc2ccc(Cl)cc2Cl)n1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 4/20 0.53
SLC16A1 P53985 4/20 0.53
MCTS1 Q9ULC4 4/20 0.53
MARS1 P56192 7/20 0.47
MALT1 Q9UDY8 1/20 0.46
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 2/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
JAK2 O60674 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
PTGER1 P34995 1/20 0.41

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
SCHEMBL8369870 0.92 SLC16A3 (0.62) SLC16A3SLC16A1MCTS1MARS1MALT1
SCHEMBL8366394 0.89 MARS1 (0.60) SLC16A3SLC16A1MCTS1MARS1MALT1
SCHEMBL8368082 0.89 SLC16A3 (0.56) SLC16A3SLC16A1MCTS1MARS1MALT1
SCHEMBL8369725 0.85 SLC16A3 (0.53) SLC16A3SLC16A1MCTS1MARS1MALT1
SCHEMBL8369780 0.84 SLC16A3 (0.52) SLC16A3SLC16A1MCTS1MARS1MALT1
SCHEMBL8368101 0.78 SLC16A3 (0.60) SLC16A3SLC16A1MCTS1MARS1MALT1
SCHEMBL8364830 0.78 MARS1 (0.69) SLC16A3SLC16A1MCTS1MARS1MALT1
SCHEMBL18307410 0.77 SLC16A3 (0.60) SLC16A3SLC16A1MCTS1MALT1NPC1
Hydrochloric Acid SCHEMBL8368102 0.77 MARS1 (0.67) SLC16A3SLC16A1MCTS1MARS1MALT1
SCHEMBL8364695 0.77 LMNA (0.44) SLC16A3SLC16A1MCTS1ALDH1A1NPC1

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-5925768-A ANTIINFLAMMATORY AGENTS; ANALGESICS, ANTICOAGULANTS, NARCOTICS SANOFI (FR) 1999-07-20 US disclosed