SCHEMBL919554

SCHEMBL919554

COc1cccc(COc2c[c]ccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.59
IDO1 P14902 2/20 0.54
AGXT P21549 2/20 0.54
MRGPRX4 Q96LA9 1/20 0.50
ABCB1 P08183 1/20 0.50
HTR1A P08908 1/20 0.50
DRD2 P14416 1/20 0.50
APP P05067 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
BCHE P06276 1/20 0.47
TAAR1 Q96RJ0 1/20 0.46
ACHE P22303 1/20 0.46

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
SCHEMBL28815833 0.89 MAOB (0.50) MAOBIDO1AGXTMRGPRX4ABCB1
SCHEMBL6153706 0.89 MAOB (0.67) MAOBIDO1AGXTMRGPRX4ABCB1
SCHEMBL921409 0.84 MAOB (0.60) MAOBIDO1ACHE
SCHEMBL920589 0.84 MAOB (0.67) MAOBIDO1AGXTMRGPRX4ABCB1
SCHEMBL921127 0.84 APP (0.53) MAOBIDO1AGXTAPPNPC1
SCHEMBL921367 0.81 MAOB (0.59) MAOBIDO1AGXTMRGPRX4
SCHEMBL919538 0.81 MAOB (0.56) MAOBIDO1AGXT
SCHEMBL2032358 0.81 CHRM2 (0.50) MAOBIDO1AGXTTAAR1
SCHEMBL5669650 0.81 MAOB (0.48) MAOBMRGPRX4
SCHEMBL13263642 0.80 MAOB (0.79) MAOBIDO1AGXTMRGPRX4ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1777427-A Aminoheteroaryl compounds as protein kinase inhibitors SUGEN INC (US) 2006-05-24 CN claimed
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed
CN-1777427-A Aminoheteroaryl compounds as protein kinase inhibitors SUGEN INC (US) 2006-05-24 CN 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 (2 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 MAOB 3730/4885IDO1 675/4885AGXT 21/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 MAOB 4351/4885IDO1 236/4885AGXT 48/4885

“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.