SCHEMBL2882860

SCHEMBL2882860

Cc1sc(Nc2cccc(Oc3ccccc3)c2)nc1C(=O)Nc1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.48
HIPK4 Q8NE63 1/20 0.47
GCK P35557 2/20 0.47
MAPT P10636 5/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HTT P42858 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RAB9A P51151 4/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 3/20 0.46
PIN1 Q13526 1/20 0.45
MAPK1 P28482 1/20 0.44
GFER P55789 1/20 0.44
PGR P06401 1/20 0.44
PLAU P00749 1/20 0.43

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
SCHEMBL2881191 0.93 KDR (0.56) KDRPTGDR2HIPK4GCKMAPT
SCHEMBL2880577 0.85 SIRT2 (0.49) PTGDR2GCKMAPTKMT2AMEN1
SCHEMBL2878165 0.79 RAB9A (0.50) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL2876767 0.77 PTGDR2 (0.51) PTGDR2MAPTKMT2AMEN1LMNA
SCHEMBL2878444 0.73 RAB9A (0.47) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL206297 0.73 PTGDR2 (0.61) PTGDR2MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL13476679 0.72 ALDH1A1 (0.49) KMT2AMEN1SMN1; SMN2KDM4ERAB9A
SCHEMBL2876769 0.70 NPC1 (0.51) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL16586316 0.69 GAA (0.63) PTGDR2MAPTKMT2AMEN1LMNA
SCHEMBL6014761 0.69 NPC1 (0.67) GCKKMT2AMEN1SMN1; SMN2KDM4E

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-2010012793-A1 FUNGICIDE AMINOTHIAZOLE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2010-02-04 WO disclosed