SCHEMBL4285680

SCHEMBL4285680

CCc1ccc(Cc2ccc(C=O)cc2OCc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 1/20 0.51
MAOA P21397 2/20 0.49
MAOB P27338 2/20 0.49
ALDH1A1 P00352 7/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.45
KDM4E B2RXH2 2/20 0.45
MAPT P10636 4/20 0.44
RAB9A P51151 3/20 0.44
HTT P42858 2/20 0.44
NPC1 O15118 2/20 0.44
HPGD P15428 2/20 0.43
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPK1 P28482 2/20 0.42
NTSR1 P30989 2/20 0.42
GAA P10253 2/20 0.42
PKM P14618 1/20 0.42

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
SCHEMBL6819289 0.92 MAOA (0.56) TACR2MAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL4284136 0.87 NPC1 (0.59) TACR2MAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL4285234 0.87 GAA (0.41) MAOAMAOBSMN1; SMN2LMNAKDM4E
SCHEMBL4285436 0.85 KDM4E (0.45) ALDH1A1LMNAKDM4EHTTHPGD
SCHEMBL4285434 0.85 KDM4E (0.45) ALDH1A1LMNAKDM4EHTTHPGD
SCHEMBL4292140 0.85 KDM4E (0.45) ALDH1A1LMNAKDM4EHTTHPGD
SCHEMBL11844159 0.84 MAPK1 (0.46) MAPTRAB9ANPC1MAPK1GAA
SCHEMBL1897186 0.82 MAOA (0.59) TACR2MAOAMAOBALDH1A1SMN1; SMN2
SCHEMBL4003289 0.81 ELANE (0.43) SMN1; SMN2MAPTRAB9AHTTNPC1
SCHEMBL14582853 0.81 MAOA (0.54) TACR2MAOAMAOBALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101472937-A Benzylphenylglucopyranoside Derivatives DAIICHI SANKYO CO LTD (JP) 2009-07-01 CN disclosed
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 TACR2 1441/4885MAOA 3770/4885MAOB 3258/4885

“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.