SCHEMBL7478376

SCHEMBL7478376

O=C(Nc1cccc(F)c1)Nc1nnc(SCc2cncc(-c3ccccc3)c2)s1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.65
TP53 P04637 2/20 0.65
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
NTRK1 P04629 1/20 0.52
NTRK2 Q16620 1/20 0.52
RAB9A P51151 6/20 0.52
NPC1 O15118 5/20 0.52
ABL1 P00519 4/20 0.52
SRC P12931 4/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ABCC8 Q09428 1/20 0.46
KCNJ11 Q14654 1/20 0.46
CCNC P24863 1/20 0.46
CDK8 P49336 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
SCHEMBL7421558 0.90 MAPT (0.56) MAPTTP53MEN1KMT2ALMNA
SCHEMBL7481013 0.85 MAPT (0.63) MAPTTP53MEN1KMT2ALMNA
SCHEMBL7476339 0.84 MAPT (0.67) MAPTTP53MEN1KMT2ALMNA
SCHEMBL7480423 0.79 MAPT (0.66) MAPTTP53MEN1KMT2ALMNA
SCHEMBL7483095 0.78 MAPT (0.67) MAPTTP53MEN1KMT2ALMNA
SCHEMBL7477859 0.76 MAPT (0.64) MAPTTP53MEN1KMT2ANTRK1
SCHEMBL7478008 0.75 MAPT (0.63) MAPTTP53MEN1KMT2ALMNA
SCHEMBL7479019 0.74 RAB9A (0.61) MAPTTP53MEN1KMT2ALMNA
SCHEMBL7482874 0.74 LMNA (0.62) MAPTMEN1KMT2ALMNAGAA
SCHEMBL7479841 0.73 NTRK1 (0.60) MAPTTP53MEN1KMT2ALMNA

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