SCHEMBL14397237

SCHEMBL14397237

CC(F)Oc1cccc2c1C(NC1CC1)=NS2(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.31
USP2 O75604 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
LMNA P02545 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
SCHEMBL12292140 0.90 KCNH2 (0.32) LMNA
SCHEMBL14397234 0.85 LMNA (0.33) POLBHSD17B10LMNA
SCHEMBL12292139 0.84 HSD17B10 (0.41) POLBUSP2CYP1A2CYP3A4CYP2D6
SCHEMBL14397233 0.83 LMNA (0.32) POLBHSD17B10LMNA
SCHEMBL14397236 0.81 HSD17B10 (0.34) TSHRHSD17B10LMNA
SCHEMBL14397239 0.81 ALDH1A1 (0.33) HSD17B10LMNA
SCHEMBL14397235 0.80 LMNA (0.31) HSD17B10LMNA
SCHEMBL14397238 0.78 MAPT (0.35) HSD17B10
SCHEMBL12292117 0.77 LMNA (0.43) POLBCYP1A2CYP3A4CYP2D6TSHR
SCHEMBL12292148 0.76 LMNA (0.34) POLBHSD17B10LMNA

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
WO-2007113119-A1 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST BASF SE (DE) 2007-10-11 WO disclosed