SCHEMBL8890914

SCHEMBL8890914

CNC(=S)NS(=O)(=O)c1cc(CC(=O)NC(C)(C)c2nccs2)ccc1C

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.39
CNR1 P21554 5/20 0.39
LMNA P02545 2/20 0.37
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.36
PPIA P62937 1/20 0.35
PKM P14618 1/20 0.34
ABCC9 O60706 1/20 0.34
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
KMT2A Q03164 2/20 0.34
FFAR2 O15552 1/20 0.34
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
SCN3A Q9NY46 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
SCHEMBL8893572 0.90 CNR2 (0.40) CNR2CNR1LMNAMAPK1SMN1; SMN2
SCHEMBL8890386 0.89 LMNA (0.35) CNR2CNR1LMNAMAPK1SMN1; SMN2
SCHEMBL8893466 0.89 LMNA (0.47) CNR2CNR1LMNAMAPK1SMN1; SMN2
SCHEMBL8891639 0.88 ALDH1A1 (0.48) CNR2CNR1LMNAMAPK1SMN1; SMN2
SCHEMBL8891686 0.87 ALDH1A1 (0.40) CNR2CNR1LMNAMAPK1SMN1; SMN2
SCHEMBL8891800 0.83 LMNA (0.36) LMNAMAPK1SMN1; SMN2ALDH1A1PKM
SCHEMBL8890057 0.81 NPC1 (0.37) LMNAMAPK1SMN1; SMN2ALDH1A1POLB
SCHEMBL8891240 0.81 ABCC9 (0.35) LMNASMN1; SMN2ALDH1A1POLBABCC9
SCHEMBL8891419 0.80 ALDH1A1 (0.36) CNR2LMNAMAPK1SMN1; SMN2ALDH1A1
SCHEMBL8891905 0.80 LMNA (0.48) CNR2CNR1LMNAMAPK1SMN1; SMN2

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-5607976-A ANNTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed