SCHEMBL30002785

SCHEMBL30002785

CCCCCCOc1ccc(OCCCCCC)c2cc(C)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
THRB P10828 3/20 0.51
ALDH1A1 P00352 3/20 0.51
GAA P10253 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
CNR1 P21554 2/20 0.45
CNR2 P34972 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HTT P42858 1/20 0.45
ESR1 P03372 2/20 0.43
THRA P10827 2/20 0.43
L3MBTL4 Q8NA19 1/20 0.43
L3MBTL3 Q96JM7 1/20 0.43
CYP2C9 P11712 1/20 0.43
CHUK O15111 1/20 0.42
DAPK3 O43293 1/20 0.42
JAK2 O60674 1/20 0.42
ROCK2 O75116 1/20 0.42
PRKCG P05129 1/20 0.42

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
SCHEMBL23271926 1.00 MAPT (0.51) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL23271714 1.00 MAPT (0.51) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL30003112 1.00 MAPT (0.51) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL30003083 0.93 MAPT (0.47) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL23271746 0.93 MAPT (0.47) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL11209459 0.89 ESR1 (0.51) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL23271869 0.87 MAPT (0.50) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL30003611 0.87 MAPT (0.50) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL14279018 0.84 MAPT (0.55) MAPTTHRBALDH1A1GAANPSR1
SCHEMBL5844334 0.84 MAPT (0.55) MAPTTHRBALDH1A1GAANPSR1

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