SCHEMBL7479019

SCHEMBL7479019

CC(C)(C)OC(=O)c1cccc(CSc2nnc(NC(=O)Nc3cccc(F)c3)s2)c1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.61
NPC1 O15118 4/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MAPT P10636 3/20 0.57
TP53 P04637 1/20 0.57
ABL1 P00519 5/20 0.56
SRC P12931 5/20 0.56
NTRK1 P04629 1/20 0.52
NTRK2 Q16620 1/20 0.52
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ABCC8 Q09428 1/20 0.50
KCNJ11 Q14654 1/20 0.50
LMNA P02545 2/20 0.48
GAA P10253 1/20 0.48
PTPN1 P18031 1/20 0.46

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
SCHEMBL7475712 0.87 MEN1 (0.50) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL7429393 0.86 RAB9A (0.59) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL7427489 0.82 MEN1 (0.58) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL7476339 0.80 MAPT (0.67) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL7481013 0.79 MAPT (0.63) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL7426341 0.79 MEN1 (0.59) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL7477611 0.78 KMT2A (0.61) RAB9ANPC1SMN1; SMN2MAPTABL1
SCHEMBL7480423 0.77 MAPT (0.66) RAB9ANPC1SMN1; SMN2MAPTTP53
SCHEMBL7428903 0.75 NPC1 (0.61) RAB9ANPC1SMN1; SMN2MAPTABL1
SCHEMBL7429153 0.74 MEN1 (0.49) RAB9ANPC1SMN1; SMN2MAPTABL1

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-1999020617-A1 ANTIINFLAMMATORY THIADIAZOLYL UREAS WHICH ACT AS LFA-1 AND MAC-1 INHIBITORS ACTIVE BIOTECH AB (SE) 1999-04-29 WO disclosed