SCHEMBL9804544

SCHEMBL9804544

Cc1c(Cc2ccccc2)c(C)c(Cc2ccccc2)c(O)c1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
GAA P10253 2/20 0.46
MAPT P10636 2/20 0.46
JAK2 O60674 1/20 0.46
POLB P06746 1/20 0.46
PKM P14618 1/20 0.46
MAPK1 P28482 1/20 0.46
MPI P34949 1/20 0.46
HTT P42858 1/20 0.46
BLM P54132 1/20 0.46
MCL1 Q07820 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CALM1 P0DP23 1/20 0.46
NQO1 P15559 2/20 0.44
SHBG P04278 1/20 0.44
ALDH1A1 P00352 4/20 0.44
HPGD P15428 1/20 0.44
BCL2 P10415 1/20 0.43
BCL2L1 Q07817 1/20 0.43
IDH1 O75874 2/20 0.43

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
SCHEMBL28313729 0.89 CALM1 (0.58) KDM4EGAAMAPTJAK2POLB
SCHEMBL10870748 0.86 KDM4E (0.43) KDM4EGAAMAPTJAK2POLB
SCHEMBL10870265 0.86 KDM4E (0.43) KDM4EGAAMAPTJAK2POLB
SCHEMBL3050270 0.85 CNR2 (0.46) KDM4EGAAMAPTJAK2POLB
SCHEMBL10906000 0.83 PTPN1 (0.54) BCL2BCL2L1
Butane SCHEMBL27554305 0.82 CNR2 (0.44) KDM4EGAAMAPTJAK2POLB
SCHEMBL30768176 0.81 CALM1 (0.55) KDM4ECALM1NQO1ALDH1A1HPGD
SCHEMBL9190942 0.81 CALM1 (0.55) KDM4EGAAMAPTJAK2POLB
SCHEMBL24505329 0.81 KDM4E (0.45) KDM4EGAAMAPTJAK2POLB
SCHEMBL27967513 0.80 KDM4E (0.44) KDM4EGAAMAPTJAK2POLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0186255-B1 PROCESS FOR PREPARING BENZYL SUBSTITUTED PHENOLS, DIBENZYLPHENOLIC COMPOUNDS, AND THE ANTIOXIDANT USE OF SUCH PHENOLS ETHYL CORPORATION (US) 1991-04-10 EP disclosed
EP-0186255-A2 Process for preparing benzyl substituted phenols, dibenzylphenolic compounds, and the antioxidant use of such phenols ETHYL CORPORATION (US) 1986-07-02 EP disclosed