SCHEMBL10692644

SCHEMBL10692644

O=C(c1ccccc1)c1cccc(NC(=O)C(Cl)CCl)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
GAA P10253 2/20 0.52
RAB9A P51151 4/20 0.49
BLM P54132 1/20 0.49
ALDH1A1 P00352 5/20 0.48
PDK1 Q15118 1/20 0.48
PDK2 Q15119 1/20 0.48
PDK3 Q15120 1/20 0.48
PDK4 Q16654 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
ATM Q13315 2/20 0.48
NPC1 O15118 1/20 0.48
HSP90AA1 P07900 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
MAPT P10636 5/20 0.47
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HTT P42858 4/20 0.47
NPSR1 Q6W5P4 2/20 0.47

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
SCHEMBL8570404 0.83 MAPT (0.58) GAARAB9AALDH1A1ATMNPC1
SCHEMBL12096453 0.76 L3MBTL1 (0.68) L3MBTL1GAARAB9ABLMALDH1A1
SCHEMBL11776619 0.76 PDK1 (0.56) L3MBTL1GAARAB9ABLMALDH1A1
SCHEMBL7745302 0.75 KCNK3 (0.79) L3MBTL1GAARAB9ABLMALDH1A1
SCHEMBL7644547 0.74 PDK1 (0.58) L3MBTL1GAARAB9ABLMALDH1A1
SCHEMBL11015498 0.73 L3MBTL1 (0.64) L3MBTL1GAARAB9ABLMALDH1A1
SCHEMBL11031257 0.73 ALDH1A1 (0.71) L3MBTL1GAARAB9ABLMALDH1A1
SCHEMBL7930578 0.73 L3MBTL1 (0.72) L3MBTL1GAARAB9ABLMALDH1A1
SCHEMBL14533438 0.72 L3MBTL1 (0.70) L3MBTL1GAARAB9ABLMALDH1A1
SCHEMBL29034583 0.72 L3MBTL1 (0.75) L3MBTL1GAARAB9ABLMALDH1A1

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-4783472-A 1H,3H-pyrrol[1,2-c]thiazole derivatives and pharmaceutical compositions containing them RHONE-POULENC SANTE (FR) 1988-11-08 US disclosed