SCHEMBL3932264

SCHEMBL3932264

COCCC(O)CC(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.39
HSD17B10 Q99714 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
BIRC2 Q13490 1/20 0.32
HPGD P15428 1/20 0.32
GPR84 Q9NQS5 4/20 0.31
SLC1A1 P43005 1/20 0.31
TET2 Q6N021 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
SCHEMBL28845576 0.88 L3MBTL1 (0.39) TSHRHSD17B10MGAMGAASI
SCHEMBL8365675 0.83 TSHR (0.36) TSHRHSD17B10MGAMGAASI
SCHEMBL3676083 0.82 TSHR (0.42) TSHRHSD17B10MGAMGAASI
SCHEMBL3676085 0.82 TSHR (0.42) TSHRHSD17B10MGAMGAASI
SCHEMBL28243 0.81 TSHR (0.50) TSHRHSD17B10MGAMGAASI
SCHEMBL17264301 0.81 TSHR (0.48) TSHRHSD17B10MGAMGAASI
SCHEMBL20377437 0.80 TSHR (0.52) TSHRHSD17B10MGAMGAASI
SCHEMBL9319754 0.80 GPR84 (0.41) TSHRHSD17B10MGAMGAASI
SCHEMBL1171425 0.80 GPR84 (0.41) TSHRHSD17B10MGAMGAASI
SCHEMBL9169806 0.80 SLC22A6 (0.52) GPR84

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-2009007814-A1 INHIBITORS OF CARBONIC ANHYDRASE PFIZER INC. (US) 2009-01-15 WO disclosed