SCHEMBL12440973

SCHEMBL12440973

COc1cccc(COc2c(C)cccc2Br)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.56
IDO1 P14902 2/20 0.51
AGXT P21549 2/20 0.51
SCN8A Q9UQD0 1/20 0.51
ABCB1 P08183 2/20 0.48
HTR1A P08908 2/20 0.48
DRD2 P14416 1/20 0.48
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KMT2A Q03164 1/20 0.46
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRA1B P35368 1/20 0.45

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
SCHEMBL12440977 0.86 MAOB (0.55) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL16800856 0.85 SCN8A (0.49) MAOBIDO1AGXTSCN8AHTR1A
SCHEMBL9905525 0.85 MAOB (0.52) MAOBIDO1AGXTSCN8AABCB1
SCHEMBL13429981 0.84 MAOB (0.55) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL12440955 0.83 MAOB (0.56) MAOBIDO1AGXTSMN1; SMN2
SCHEMBL13429709 0.83 MAOB (0.54) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL12514352 0.83 MAOB (0.54) MAOBIDO1AGXTABCB1HTR1A
SCHEMBL12772155 0.81 HTR1A (0.50) MAOBSCN8AHTR1AMAPTSMN1; SMN2
SCHEMBL6272595 0.79 MAOB (0.50) MAOBIDO1AGXTSCN8AABCB1
SCHEMBL9893668 0.79 MAOB (0.50) MAOBIDO1AGXTABCB1HTR1A

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-9318706-B2 Laminated structure, method for producing same, and electronic element comprising same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-04-19 US disclosed
US-20110177312-A1 LAMINATED STRUCTURE, METHOD FOR PRODUCING SAME, AND ELECTRONIC ELEMENT COMPRISING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-21 US 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-20110177312-A1 LAMINATED STRUCTURE, METHOD FOR PRODUCING SAME, AND ELECTRONIC ELEMENT COMPRISING SAME EPCAM, ITGA1, ITGB1 MAOB 2353/4885IDO1 4058/4885AGXT 3319/4885

“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.