SCHEMBL30004112

SCHEMBL30004112

COCCOc1ccc(OCCOC)c2cc(C)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 12/20 0.47
MAPT P10636 10/20 0.47
HPGD P15428 7/20 0.47
ALDH1A1 P00352 4/20 0.47
CYP2C9 P11712 3/20 0.47
CYP2C19 P33261 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
USP2 O75604 2/20 0.47
POLB P06746 2/20 0.47
ALOX12 P18054 1/20 0.47
MAPK1 P28482 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
KDM4E B2RXH2 4/20 0.43
TDP1 Q9NUW8 3/20 0.43
L3MBTL4 Q8NA19 1/20 0.41
L3MBTL3 Q96JM7 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.41

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
SCHEMBL23271709 1.00 L3MBTL1 (0.47) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL30003611 0.83 MAPT (0.50) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL23271869 0.83 MAPT (0.50) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL12781859 0.82 L3MBTL1 (0.61) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL23271644 0.81 IDO1 (0.51) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL23271746 0.81 MAPT (0.47) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL30002635 0.81 IDO1 (0.51) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL30003083 0.81 MAPT (0.47) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL12180458 0.81 HPGD (0.56) L3MBTL1MAPTHPGDALDH1A1CYP2C9
SCHEMBL23271958 0.81 KCNA3 (0.46) L3MBTL1MAPTHPGDALDH1A1POLB

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
CN-110891980-B Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2022-09-30 CN disclosed