SCHEMBL9744862

SCHEMBL9744862

Clc1ccc(-c2cn3c(n2)SCC3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 1.00
NPC1 O15118 8/20 1.00
RAB9A P51151 8/20 1.00
SMN1; SMN2 Q16637 5/20 1.00
MEN1 O00255 7/20 0.72
KMT2A Q03164 7/20 0.72
GAA P10253 2/20 0.72
GFER P55789 1/20 0.72
TP53 P04637 1/20 0.71
GLA P06280 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
LMNA P02545 2/20 0.67
NFKB1 P19838 1/20 0.67
NFKB2 Q00653 1/20 0.67
RELA Q04206 1/20 0.67
ALDH1A1 P00352 4/20 0.62
KDM4E B2RXH2 2/20 0.62
NSD2 O96028 1/20 0.62
ALPL P05186 1/20 0.62
POLB P06746 1/20 0.62

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
SCHEMBL9744176 0.84 MAPT (0.72) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9742712 0.84 MAPT (0.72) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9742689 0.83 MAPT (1.00) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL3202839 0.81 MAPT (0.71) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9738237 0.80 MAPT (0.67) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL14062036 0.79 MAPT (0.64) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL13856561 0.77 MAPT (1.00) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL4424341 0.77 KMT2A (0.70) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL8086759 0.75 NPC1 (0.60) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL10562991 0.75 MEN1 (1.00) MAPTNPC1RAB9ASMN1; SMN2MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203787-B1 Process for preparing pyridyl-substituted imidazo[2,1-b]thiazoles and thiazines SMITHKLINE BEECHAM CORPORATION (US) 1992-12-30 EP disclosed
US-5008390-A Compounds for preparing 6-phenyl-2,3-dihydroimidazo[2,1-b]-thiazoles and corresponding thiazines SMITHKLINE BECKMAN CORPORATION (US) 1991-04-16 US disclosed
US-4803279-A 1.4-dihydro-4-pyridyl-substituted imidazo (2,1-b) thiazoles and the corresponding thiazines. SMITHKLINE BECKMAN CORPORATION (US) 1989-02-07 US disclosed
EP-0203787-A2 Process for preparing pyridyl-substituted imidazo[2,1-b]thiazoles and thiazines SMITHKLINE BEECHAM CORPORATION (US) 1986-12-03 EP disclosed