SCHEMBL7474057

SCHEMBL7474057

CCCC(Sc1nnc(NC(=O)Nc2cccc(F)c2)s1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.61
TP53 P04637 3/20 0.61
RAB9A P51151 4/20 0.53
NPC1 O15118 3/20 0.53
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HIF1A Q16665 1/20 0.49
NTRK1 P04629 1/20 0.47
NTRK2 Q16620 1/20 0.47
PAX8 Q06710 1/20 0.47
NLRP3 Q96P20 1/20 0.47
MTOR P42345 1/20 0.47
CCNC P24863 1/20 0.45
CDK8 P49336 1/20 0.45
LMNA P02545 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
SCHEMBL7482445 0.92 MAPT (0.63) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7477984 0.85 MAPT (0.56) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7478572 0.83 MAPT (0.57) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7476548 0.83 MAPT (0.54) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7476148 0.81 MAPT (0.61) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7482437 0.81 MAPT (0.53) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7477997 0.80 MAPT (0.60) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7480875 0.79 MAPT (0.58) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7478240 0.77 MAPT (0.51) MAPTTP53RAB9ANPC1MEN1
SCHEMBL7483976 0.77 MAPT (0.53) MAPTTP53RAB9ANPC1MEN1

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