SCHEMBL7846777

SCHEMBL7846777

COC(=O)c1ccoc1Cn1c(=O)[nH]c(C(=O)c2cc(C)cc(C)c2)c(C(C)C)c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 3/20 0.33
THRB P10828 1/20 0.33
ALDH1A1 P00352 6/20 0.32
GAA P10253 5/20 0.32
KDM4E B2RXH2 4/20 0.32
HSD17B10 Q99714 3/20 0.32
HTT P42858 2/20 0.32
GLA P06280 2/20 0.32
HPGD P15428 2/20 0.32
KMT2A Q03164 2/20 0.32
PKM P14618 1/20 0.32
GSK3B P49841 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL6087200 0.85 KMT2A (0.34) SMN1; SMN2LMNAMAPTTHRBALDH1A1
SCHEMBL6086522 0.78 SMN1; SMN2 (0.33) SMN1; SMN2LMNAMAPTTHRBALDH1A1
SCHEMBL6086953 0.78 KMT2A (0.35) SMN1; SMN2MAPTTHRBALDH1A1GAA
SCHEMBL6087839 0.78 MAPT (0.32) SMN1; SMN2LMNAMAPTTHRBALDH1A1
SCHEMBL7846575 0.77 HPD (0.41) SMN1; SMN2MAPTALDH1A1KDM4EHPGD
SCHEMBL7849860 0.76 DHODH (0.33) SMN1; SMN2MAPTTHRBKMT2AGSK3B
SCHEMBL7848710 0.76 MTNR1A (0.37) SMN1; SMN2LMNAMAPTALDH1A1GAA
SCHEMBL7847168 0.76 MTNR1A (0.49) MAPTTHRBALDH1A1KDM4EHSD17B10
SCHEMBL7846719 0.74 TYMS (0.41) ALDH1A1KDM4ECHRM4CHRM3
SCHEMBL7847828 0.74 MEN1 (0.33) SMN1; SMN2MAPTALDH1A1KMT2ATP53

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-1100786-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2001-05-23 EP disclosed
WO-2000061564-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-10-19 WO disclosed