SCHEMBL9565912

SCHEMBL9565912

Cc1cc(O)c2c(=O)c(C)c(-c3ccc(O)cc3)oc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLH Q9Y253 4/20 0.65
CYP3A4 P08684 7/20 0.59
ABCB1 P08183 7/20 0.59
CYP2D6 P10635 5/20 0.59
CYP2C9 P11712 5/20 0.59
ALDH1A1 P00352 5/20 0.59
FTO Q9C0B1 5/20 0.59
MEN1 O00255 5/20 0.59
KMT2A Q03164 5/20 0.59
KDM4E B2RXH2 4/20 0.59
CYP2C19 P33261 4/20 0.59
CYP1A1 P04798 4/20 0.59
CYP1A2 P05177 4/20 0.59
CYP1B1 Q16678 4/20 0.59
TDP1 Q9NUW8 4/20 0.59
ALOX5 P09917 4/20 0.59
MAPT P10636 4/20 0.59
XDH P47989 4/20 0.59
ALOX15 P16050 4/20 0.59
CA12 O43570 3/20 0.59

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
SCHEMBL30819258 0.90 POLH (0.80) POLHCYP3A4ABCB1CYP2D6CYP2C9
SCHEMBL6140182 0.90 POLH (0.80) POLHCYP3A4ABCB1CYP2D6CYP2C9
SCHEMBL14769773 0.89 MEN1 (0.76) POLHCYP3A4ABCB1CYP2D6CYP2C9
SCHEMBL12557415 0.86 POLH (0.62) POLHCYP3A4ABCB1CYP2D6CYP2C9
SCHEMBL23919099 0.81 MEN1 (0.65) POLHCYP3A4ABCB1CYP2D6CYP2C9
SCHEMBL9733297 0.81 ABCB1 (0.76) POLHCYP3A4ABCB1CYP2D6CYP2C9
SCHEMBL12636895 0.80 CYP3A4 (0.74) POLHCYP3A4ABCB1CYP2D6CYP2C9
SCHEMBL824468 0.79 POLH (1.00) POLHCYP3A4ABCB1CYP2D6CYP2C9
SCHEMBL18130383 0.79 ALOX5 (0.62) POLHCYP3A4ABCB1CYP2D6MEN1
SCHEMBL12919332 0.78 POLH (0.70) POLHCYP3A4ABCB1CYP2D6KDM4E

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-0548798-A1 Antiviral agent SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1993-06-30 EP disclosed