SCHEMBL7907173

SCHEMBL7907173

CCOC(=O)C1C(=O)Oc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
ATM Q13315 2/20 0.56
KMT2A Q03164 6/20 0.56
MEN1 O00255 5/20 0.56
CYP1A2 P05177 2/20 0.56
CHRM2 P08172 2/20 0.56
CYP2D6 P10635 2/20 0.56
CHRM1 P11229 2/20 0.56
KCNH2 Q12809 2/20 0.56
LMNA P02545 2/20 0.56
USP2 O75604 1/20 0.53
TSHR P16473 4/20 0.51
CYP3A4 P08684 1/20 0.51
NFKB1 P19838 1/20 0.51
KDM4E B2RXH2 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 2/20 0.50
APEX1 P27695 1/20 0.50
RECQL P46063 1/20 0.50
PMP22 Q01453 1/20 0.50

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
SCHEMBL595243 0.89 ATM (0.69) POLBATMKMT2AMEN1CYP1A2
SCHEMBL17562151 0.78 KMT2A (0.71) POLBATMKMT2AMEN1CYP1A2
SCHEMBL2736397 0.77 ATM (0.71) POLBATMKMT2AMEN1CYP1A2
SCHEMBL7720566 0.76 ATM (0.56) ATMKMT2AMEN1LMNAUSP2
SCHEMBL2736392 0.76 ATM (0.66) POLBATMKMT2AMEN1CYP1A2
SCHEMBL11129976 0.75 ATM (0.76) ATMKMT2AMEN1LMNAUSP2
SCHEMBL1419881 0.75 CYP1A2 (0.55) POLBATMKMT2AMEN1CYP1A2
SCHEMBL6866118 0.75 POLB (0.67) POLBKMT2AMEN1MAPTNPSR1
SCHEMBL29171698 0.74 KMT2A (0.48) POLBATMKMT2AMEN1CYP1A2
SCHEMBL29171700 0.74 KMT2A (0.48) POLBATMKMT2AMEN1CYP1A2

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-6194590-B1 PREPARING SUBSTITUTED BENZOFURAN-3-ONES BY REACTING SALICYLIC ACID ETHER COMPOUND WITH STRONG BASE IN INERT GAS AND/OR IN PRESENCE OF DILUENT; REACTING BENZOFURANONECARBOXYIC ACID ESTER WITH POTASSIUM HYDROXIDE AND THEN ACID ACID BAYER AKTIENGESELLSCHAFT (DE) 2001-02-27 US disclosed