SCHEMBL4289158

SCHEMBL4289158

CC1CC(=O)C(C(=O)c2ccc(OC(C)C)cc2)C(=O)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.50
PARP10 Q53GL7 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 2/20 0.45
HPGD P15428 2/20 0.45
RAB9A P51151 2/20 0.45
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 4/20 0.40
ALDH1A1 P00352 4/20 0.40
POLB P06746 2/20 0.40
TSHR P16473 1/20 0.40
TP53 P04637 3/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
NR1H4 Q96RI1 1/20 0.39
GAA P10253 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
MCL1 Q07820 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL4288059 0.77 L3MBTL1 (0.49) SMN1; SMN2NPC1HPGDRAB9AMAPT
SCHEMBL15133259 0.76 TPMT (0.39) MAPTHTT
SCHEMBL18227958 0.76 HTT (0.52) NPC1MAPTALDH1A1HTTLMNA
SCHEMBL30949371 0.74 NPC1 (0.60) KMT2APARP10SMN1; SMN2NPC1HPGD
SCHEMBL4282979 0.71 KMT2A (0.44) KMT2APARP10SMN1; SMN2NPC1HPGD
SCHEMBL2517350 0.69 KMT2A (0.73) KMT2APARP10SMN1; SMN2NPC1HPGD
SCHEMBL27568057 0.68 KMT2A (0.82) KMT2APARP10SMN1; SMN2NPC1HPGD
SCHEMBL103890 0.68 KMT2A (0.70) KMT2APARP10SMN1; SMN2NPC1HPGD
SCHEMBL503642 0.68 KMT2A (1.00) KMT2APARP10SMN1; SMN2NPC1HPGD
SCHEMBL12532571 0.67 KMT2A (0.63) KMT2APARP10SMN1; SMN2NPC1HPGD

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
US-20090137499-A1 BENZYLPHENYL GLUCOPYRANOSIDE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-05-28 US disclosed
EP-2048150-A1 BENZYL PHENYL GLUCOPYRANOSIDE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2009-04-15 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090137499-A1 BENZYLPHENYL GLUCOPYRANOSIDE DERIVATIVE SLC5A1, SLC5A2, SLC2A1 KMT2A 1397/4885PARP10 2557/4885SMN1; SMN2 4337/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.