SCHEMBL11299176

SCHEMBL11299176

CCCCCCCCCCCCCCCCCC[S+](c1ccccc1)c1ccccc1C.F[B-](F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.32
P2RX7 Q99572 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
TSHR P16473 1/20 0.30
DNM1 Q05193 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
HSD11B1 P28845 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
SCHEMBL11310581 0.86 MGLL (0.36) MGLLGPR84TSHRDNM1ALDH1A1
SCHEMBL11312789 0.86 MGLL (0.36) MGLLGPR84TSHRDNM1ALDH1A1
SCHEMBL11309699 0.86 MGLL (0.36) MGLLGPR84TSHRDNM1ALDH1A1
SCHEMBL11340973 0.86 MGLL (0.36) MGLLGPR84TSHRDNM1ALDH1A1
SCHEMBL11346850 0.84 GPR84 (0.37) MGLLGPR84TSHRDNM1ALDH1A1
SCHEMBL3213176 0.79 DNM1 (0.40) DNM1TP53
SCHEMBL3200927 0.79 DNM1 (0.40) DNM1TP53
SCHEMBL10680057 0.77 LTA4H (0.38) GPR84DNM1TP53
SCHEMBL11301243 0.74 DNM1 (0.35) MGLLTSHRDNM1ALDH1A1TP53
SCHEMBL11305722 0.74 DNM1 (0.35) MGLLTSHRDNM1ALDH1A1TP53

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
US-4287355-A USED TO RETARD PASSAGE OF GLUCOSE INTO THE BLOOD SANDOZ, INC. (US) 1981-09-01 US disclosed