SCHEMBL28037073

SCHEMBL28037073

NCc1ccc(-c2ncsc2N)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 4/20 0.50
HRH3 Q9Y5N1 1/20 0.48
ADRB2 P07550 1/20 0.46
LTA4H P09960 1/20 0.44
TAAR1 Q96RJ0 4/20 0.42
CYP2A6 P11509 1/20 0.38
NSD2 O96028 1/20 0.37
ASIC3 Q9UHC3 1/20 0.37
ABAT P80404 1/20 0.35
F9 P00740 1/20 0.35
F11 P03951 1/20 0.35
F7 P08709 1/20 0.35
CYP2C9 P11712 1/20 0.35
AKT2 P31751 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL27574327 0.79 LOXL2 (0.45) LOXL2HRH3ADRB2LTA4HTAAR1
SCHEMBL28312818 0.76 ADORA1 (0.49)
SCHEMBL543734 0.75 ADORA1 (0.47) SMN1; SMN2
SCHEMBL28242972 0.73 ADRB2 (0.59) LOXL2HRH3ADRB2LTA4HTAAR1
SCHEMBL15110380 0.70 VHL (0.57) LOXL2HRH3ADRB2LTA4HTAAR1
Hydrochloric Acid SCHEMBL21070735 0.69 VHL (0.56) LOXL2HRH3ADRB2LTA4HTAAR1
Hydrochloric Acid SCHEMBL26909801 0.69 VHL (0.56) LOXL2HRH3ADRB2LTA4HTAAR1
SCHEMBL2274647 0.68 HRH3 (1.00) LOXL2HRH3ADRB2LTA4HTAAR1
SCHEMBL16298860 0.68 HRH3 (0.52) LOXL2HRH3ADRB2LTA4HTAAR1
SCHEMBL25592519 0.68 LOXL2 (0.45) LOXL2HRH3ADRB2LTA4HTAAR1

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
CN-104910095-B The preparation method of 4-replacement-thiazolamine compound 浙江大学 2017-01-04 CN disclosed
CN-104910095-A Preparation method of 4-substituted-2-aminothiazole compound UNIV ZHEJIANG 2015-09-16 CN disclosed