SCHEMBL18639409

SCHEMBL18639409

COc1cc(C)c(OCCOc2c(C)cc(OC)cc2OC)c(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.47
CYP1A2 P05177 2/20 0.44
BRD4 O60885 1/20 0.44
MAPT P10636 5/20 0.42
L3MBTL1 Q9Y468 5/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ACHE P22303 1/20 0.40
CYP1A1 P04798 1/20 0.40
CYP1B1 Q16678 1/20 0.40
PTPN1 P18031 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL10044945 0.90 L3MBTL1 (0.45) MAPK1CYP1A2BRD4MAPTL3MBTL1
SCHEMBL10044605 0.89 BRD4 (0.55) MAPK1CYP1A2BRD4MAPTL3MBTL1
SCHEMBL18292053 0.87 MAPK1 (0.58) MAPK1CYP1A2BRD4SMN1; SMN2ACHE
SCHEMBL10044942 0.87 BRD4 (0.48) MAPK1CYP1A2BRD4MAPTL3MBTL1
SCHEMBL10044441 0.84 BRD4 (0.40) MAPK1CYP1A2BRD4L3MBTL1CYP1A1
SCHEMBL10044524 0.84 BRD4 (0.38) MAPK1CYP1A2BRD4MAPTL3MBTL1
SCHEMBL684136 0.83 ACHE (0.52) CYP1A2MAPTLMNAKDM4EACHE
SCHEMBL18292070 0.81 SMN1; SMN2 (0.59) MAPK1CYP1A2BRD4MAPTL3MBTL1
SCHEMBL10044445 0.80 LMNA (0.48) CYP1A2BRD4LMNAKDM4EPTPN1
SCHEMBL10044447 0.79 BRD4 (0.45) CYP1A2BRD4L3MBTL1PTPN1

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
EP-3141958-A2 CHEMICALLY AMPLIFIED RESIST MATERIAL AND RESIST PATTERN-FORMING METHOD JSR Corporation (JP) 2017-03-15 EP disclosed