SCHEMBL5207615

SCHEMBL5207615

COc1cc(-c2ccc(N(C)CCN(C)c3ccc(-c4cc(OC)c(O)c(OC)c4)nc3)cn2)cc(OC)c1O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 5/20 0.41
APP P05067 1/20 0.41
ERN1 O75460 1/20 0.40
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
FYN P06241 2/20 0.37
MTOR P42345 1/20 0.37
IDO1 P14902 2/20 0.36
TDO2 P48775 2/20 0.36

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
SCHEMBL5204261 0.95 SMPD3 (0.40) SMPD3APPERN1KDM4EGAA
SCHEMBL5208394 0.93 MELK (0.40) SMPD3APPERN1FYNIDO1
SCHEMBL5209121 0.88 MELK (0.39) SMPD3APPERN1FYNIDO1
SCHEMBL5210909 0.87 KDM1A (0.37) MAPTFYN
SCHEMBL5207852 0.87 FYN (0.43) FYN
SCHEMBL5204509 0.86 KDM1A (0.46) FYNIDO1TDO2
SCHEMBL5203414 0.86 FGFR1 (0.38)
SCHEMBL5208946 0.86 PDGFRB (0.37) FYN
SCHEMBL5207435 0.84 FYN (0.36) FYN
SCHEMBL5207725 0.84 ALDH1A1 (0.39) APPFYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1403251-B1 BIS(2-ARYL-5-PYRIDYL) DERIVATIVE KOWA CO (JP) 2007-07-18 EP disclosed
US-6890940-B2 Bis(2-aryl-5-pyridyl) derivatives KOWA CO., LTD. (JP) 2005-05-10 US disclosed
EP-1403251-A1 BIS(2-ARYL-5-PYRIDYL) DERIVATIVE Kowa Co., Ltd. (JP) 2004-03-31 EP disclosed
US-20030022886-A1 Immoglobulin E (IgE) antibody production inhibitor; treating allergic immune diseases such as asthma, dermatitis, inflammatory bowel disease and allergic opthalmopathy KOWA CO., LTD. (JP) 2003-01-30 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-20030022886-A1 Immoglobulin E (IgE) antibody production inhibitor; treating allergic immune diseases such as asthma, dermatitis, inflammatory bowel disease and allergic opthalmopathy IGLV6-57, IL5, IGSF11 SMPD3 3449/4885APP 182/4885ERN1 2091/4885

“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.