SCHEMBL1108418

SCHEMBL1108418

CCC(O)CN(CC(O)COc1ccccc1)c1cccc(S(=O)(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
HIF1A Q16665 1/20 0.43
GAA P10253 2/20 0.43
ABCB1 P08183 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PKM P14618 1/20 0.40
KMT2A Q03164 1/20 0.40
CETP P11597 1/20 0.39
KAT6A Q92794 1/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
CYP2D6 P10635 1/20 0.38
ADRB3 P13945 1/20 0.38

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
SCHEMBL1108386 0.95 HIF1A (0.44) POLBHIF1AGAAABCB1L3MBTL1
SCHEMBL1108408 0.89 GAA (0.39) POLBHIF1AGAAABCB1L3MBTL1
SCHEMBL1108384 0.87 ALDH1A1 (0.41) ALDH1A1KMT2A
SCHEMBL1108390 0.79 ALDH1A1 (0.37) POLBGAAL3MBTL1ALDH1A1CETP
SCHEMBL21792721 0.77 POLB (0.54) POLBHIF1AGAAABCB1L3MBTL1
SCHEMBL19000407 0.75 CA2 (0.46) KMT2A
SCHEMBL11663021 0.75 POLB (0.51) POLBHIF1AALDH1A1PKMKMT2A
SCHEMBL12130988 0.75 KAT6A (0.39) GAAL3MBTL1ALDH1A1PKMKMT2A
SCHEMBL1108385 0.74 CETP (0.42) L3MBTL1ALDH1A1KMT2ACETP
SCHEMBL13296458 0.74 HIF1A (0.44) POLBHIF1AABCB1L3MBTL1ALDH1A1

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
US-8153283-B2 Magnetic recording medium, method of modifying surface of magnetic powder and magnetic coating material FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-8153283-B2 Magnetic recording medium, method of modifying surface of magnetic powder and magnetic coating material FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed