SCHEMBL9112908

SCHEMBL9112908

ClNc1cccc2snnc12

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.32
TP53 P04637 1/20 0.32
HTT P42858 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
PKLR P30613 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL5776938 0.77 MAPT (0.32) MAPTTP53HTTMEN1LMNA
SCHEMBL5355939 0.69
SCHEMBL4615662 0.69 F9 (0.30)
SCHEMBL289345 0.69
SCHEMBL346282 0.69
SCHEMBL29942154 0.69 BACE1 (0.35) MAPTMEN1LMNAKMT2A
SCHEMBL6964252 0.69 ADRA2A (0.51) MAPTMEN1LMNAKMT2ANPSR1
SCHEMBL29527999 0.67 ALDH1A1 (0.37) MAPTTP53HTTMEN1LMNA
SCHEMBL28754170 0.67 ALDH1A1 (0.37) MAPTTP53HTTMEN1LMNA
SCHEMBL3503184 0.67 PKLR (0.38) PKLRALDH1A1

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
JP-7082268-A None JP disclosed
JP-H0782268-A PRODUCTION OF BENZOTHIADIAZOLE DERIVATIVE PERMACHEM ASIA LTD 1995-03-28 JP disclosed