SCHEMBL7260462

SCHEMBL7260462

COC(=O)c1[c]c(SC)ccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.42
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA12 O43570 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
RAB9A P51151 2/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
LOXL2 Q9Y4K0 1/20 0.37
LMNA P02545 1/20 0.35
MAPT P10636 2/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
HSD17B10 Q99714 3/20 0.35

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
SCHEMBL127720 0.82 CA1 (0.52) L3MBTL1CA1CA2CA12CA7
SCHEMBL9195826 0.76 CA1 (0.50) L3MBTL1CA1CA2CA12CA7
SCHEMBL8026225 0.76 CA1 (0.45) L3MBTL1CA1CA2CA12CA7
SCHEMBL4390548 0.74 CA1 (0.44) CA1CA2CA12CA7CA9
SCHEMBL3891739 0.74 CA12 (0.44) CA1CA2CA12CA7CA9
SCHEMBL4449415 0.71
SCHEMBL28629039 0.69 CA1 (0.39) CA1CA2CA12CA7CA9
SCHEMBL9165945 0.67 KDM4E (0.31) SMN1; SMN2ALDH1A1
SCHEMBL6653152 0.66
SCHEMBL51251 0.66 TSHR (0.48) L3MBTL1CA1CA2CA12CA7

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
WO-2003103666-A2 NOVEL 4,5-DIHYDRO-IMIDAZO[4,5,1-IJ]QUINOLIN-6-ONES ALTANA PHARMA AG (DE) 2003-12-18 WO claimed