SCHEMBL9947574

SCHEMBL9947574

CC(C)(C)OC(=O)COc1ccc(OCC(=O)OC(C)(C)C)c([S+](c2ccccc2)c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
HPGD P15428 3/20 0.47
POLB P06746 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
PTPN1 P18031 2/20 0.43
LMNA P02545 1/20 0.42
ACLY P53396 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CTSK P43235 1/20 0.37

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
SCHEMBL3190064 0.93 MAPT (0.43) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3190469 0.93 POLB (0.43) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3181577 0.93 PTPN1 (0.43) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3204820 0.93 MAPT (0.43) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3181640 0.90 MAPT (0.49) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3192462 0.88 MAPT (0.42) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3193941 0.88 PTGDR2 (0.43) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3183354 0.88 MAPT (0.47) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3182687 0.88 PSEN1 (0.43) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3190437 0.86 MAPT (0.50) MAPTHPGDPOLBCYP2C9CYP2C19

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-8206888-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2012-06-26 US disclosed