SCHEMBL11097237

SCHEMBL11097237

CC(=O)N(S)S.Cc1cn2cccc(OCc3ccccc3)c2n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 3/20 0.49
ATP4B P51164 3/20 0.49
HRH3 Q9Y5N1 1/20 0.46
BRD4 O60885 2/20 0.43
MAPK1 P28482 2/20 0.43
CYP2C9 P11712 2/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
PSEN1 P49768 5/20 0.40
PSEN2 P49810 5/20 0.40
APH1B Q8WW43 5/20 0.40
NCSTN Q92542 5/20 0.40
APH1A Q96BI3 5/20 0.40
PSENEN Q9NZ42 5/20 0.40

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
SCHEMBL2189993 0.88 ATP4A (0.60) ATP4AATP4BHRH3BRD4MAPK1
Dimebutic Acid SCHEMBL10535100 0.83 ATP4A (0.47) ATP4AATP4BHRH3BRD4MAPK1
SCHEMBL2191140 0.78 MEN1 (0.51) ATP4AATP4BHRH3MAPK1CYP2C9
SCHEMBL2194287 0.77 PPARG (0.50) ATP4AATP4BHRH3MAPK1CYP2C9
SCHEMBL11096196 0.77 ATP4A (0.50) ATP4AATP4BHRH3BRD4MAPK1
SCHEMBL11070583 0.76 KDM4E (0.52) ATP4AATP4BHRH3MAPK1CYP2C9
SCHEMBL7849956 0.76 PPARG (0.60) ATP4AATP4BHRH3MAPK1CYP2C9
SCHEMBL10675888 0.75 NPC1 (0.51) ATP4AATP4BMEN1KMT2AMAPT
SCHEMBL11100065 0.74 ATP4A (0.47) ATP4AATP4BHRH3MAPK1CYP2C9
SCHEMBL9746834 0.74 PPARG (0.50) ATP4AATP4BMAPTPPARG

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
EP-0033094-B1 IMIDAZO(1,2-A)PYRIDINES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1984-10-10 EP claimed