SCHEMBL16623333

SCHEMBL16623333

CNc1ccc(C(=O)Nc2ccc(-c3nc4ccc(OC)cc4s3)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.77
SCD O00767 5/20 0.60
NPC1 O15118 3/20 0.60
RAB9A P51151 3/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
MAPT P10636 5/20 0.60
LMNA P02545 1/20 0.56
SULT1A1 P50225 1/20 0.56
MMP2 P08253 1/20 0.56
MMP9 P14780 1/20 0.56
MMP8 P22894 1/20 0.56
MMP13 P45452 1/20 0.56
TP53 P04637 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL1985009 0.95 SCD (0.67) APPSCDNPC1RAB9AMEN1
SCHEMBL16623336 0.92 MAPT (0.64) APPSCDNPC1RAB9AMEN1
SCHEMBL2193639 0.92 APP (0.63) APPSCDNPC1RAB9AMEN1
SCHEMBL2191507 0.91 APP (0.71) APPSCDNPC1RAB9AMEN1
SCHEMBL2192963 0.91 APP (0.71) APPSCDNPC1RAB9AMEN1
SCHEMBL1983311 0.90 MMP2 (0.69) APPSCDNPC1RAB9AMEN1
SCHEMBL2193573 0.90 APP (0.60) APPSCDNPC1RAB9AMEN1
SCHEMBL2196579 0.89 APP (0.59) APPSCDNPC1RAB9AMEN1
SCHEMBL12509332 0.89 APP (0.59) APPSCDNPC1RAB9AMEN1
SCHEMBL2192191 0.89 APP (0.72) APPSCDNPC1RAB9AMEN1

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
EP-2338059-B1 Ligands for aggregated tau molecules WISTA LAB LTD (SG) 2015-04-08 EP disclosed