SCHEMBL28007948

SCHEMBL28007948

CCCCc1csc(Nc2cccc(Cl)c2)n1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.62
GAA P10253 2/20 0.62
KDM1A O60341 1/20 0.55
ADRB2 P07550 1/20 0.51
ADRB1 P08588 1/20 0.51
ADRB3 P13945 1/20 0.51
CYP1A1 P04798 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP1B1 Q16678 1/20 0.50
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
PLA2G7 Q13093 1/20 0.49
CTPS1 P17812 5/20 0.48
CPB1 P15086 1/20 0.48
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CFTR P13569 1/20 0.47
USP2 O75604 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL28818145 0.84 ALDH1A1 (0.59) MAPTGAAKDM1AADRB2ADRB1
SCHEMBL27812589 0.84 ADRB2 (0.67) MAPTGAAADRB2ADRB1ADRB3
SCHEMBL28787879 0.82 MAPT (0.64) MAPTGAAADRB2ADRB1ADRB3
Bromide SCHEMBL27812101 0.82 ADRB2 (0.65) MAPTGAAADRB2ADRB1ADRB3
SCHEMBL28007623 0.81 VCP (0.54) MAPTGAAADRB2ADRB1ADRB3
Bromide SCHEMBL27832198 0.81 MAPT (0.62) MAPTGAAADRB2ADRB1ADRB3
SCHEMBL491436 0.80 ADRB2 (0.72) MAPTGAAADRB2ADRB1ADRB3
SCHEMBL28007593 0.79 PLA2G7 (0.60) MAPTGAAADRB2ADRB1ADRB3
SCHEMBL5494002 0.79 ADRB2 (0.74) MAPTGAAADRB2ADRB1ADRB3
SCHEMBL28007897 0.76 NPC1 (0.60) MAPTKDM1AADRB2ADRB1ADRB3

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-104530035-A 5-piperonyl-4-alkyl-2-aromatic aminothiazole and preparing method and application thereof UNIV HUNAN 2015-04-22 CN claimed
CN-104530035-A 5-piperonyl-4-alkyl-2-aromatic aminothiazole and preparing method and application thereof UNIV HUNAN 2015-04-22 CN disclosed