SCHEMBL8104907

SCHEMBL8104907

COc1cc(OC)nc(COc2cccc(O)c2C(=O)OCc2ccccc2)n1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
MAOB P27338 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.40
PRKCZ Q05513 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 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
SCHEMBL9191891 0.86 ALDH1A1 (0.48) MEN1POLBKMT2A
SCHEMBL28097048 0.81 TDP1 (0.56) MEN1POLBKMT2ATDP1PRKCZ
SCHEMBL27032917 0.79 CA12 (0.55) MEN1KMT2AMAOBTDP1MRGPRX4
SCHEMBL9193808 0.78 ALDH1A1 (0.52)
SCHEMBL8323146 0.76 CA12 (0.64) KMT2AMAOBTDP1MRGPRX4LMNA
SCHEMBL17221624 0.76 ADORA3 (0.44) MEN1POLBKMT2ATDP1MRGPRX4
SCHEMBL5120937 0.76 CA12 (0.59) MAOBTDP1MRGPRX4LMNAHPGD
SCHEMBL2580651 0.76 KMT2A (0.56) MEN1POLBKMT2ATDP1MRGPRX4
SCHEMBL3919215 0.75 TDP1 (0.71) KMT2ATDP1LMNAHPGD
SCHEMBL9221963 0.75 CYP1A2 (0.52)

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
JP-2000159753-A SALICYLIC ACID COMPOUND AND HERBICIDE NISSAN CHEM IND LTD 2000-06-13 JP disclosed