SCHEMBL5207785

SCHEMBL5207785

COc1cc(-c2ccc(C(N)CCN(C)CCC(N)c3ccc(-c4cc(OC)c(OCC(F)(F)F)c(OC)c4)nc3)cn2)cc(OC)c1OCC(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.33
SCN9A Q15858 1/20 0.32
FYN P06241 4/20 0.32
HRH4 Q9H3N8 1/20 0.32
CYP17A1 P05093 1/20 0.32
PDE4B Q07343 1/20 0.32
ALOX5AP P20292 2/20 0.31
FEN1 P39748 2/20 0.31
AAK1 Q2M2I8 1/20 0.30
NEK2 P51955 1/20 0.30

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
SCHEMBL5204525 0.80 FYN (0.41) FYN
SCHEMBL5203320 0.78 KDM1A (0.33) KDM1ASCN9AFYNALOX5APFEN1
SCHEMBL5203600 0.77 SCN9A (0.36) KDM1ASCN9AFYNCYP17A1PDE4B
SCHEMBL5203313 0.77 SCN9A (0.33) KDM1ASCN9AFYNCYP17A1PDE4B
Hydrochloric Acid SCHEMBL5208557 0.77 KDM1A (0.33) KDM1ASCN9AALOX5APFEN1AAK1
SCHEMBL5206025 0.77 KDM1A (0.42) KDM1ASCN9AFYNALOX5APFEN1
Hydrochloric Acid SCHEMBL5204974 0.76 SCN9A (0.33) KDM1ASCN9AFYNCYP17A1PDE4B
SCHEMBL5207778 0.76 CYP17A1 (0.36) KDM1ASCN9ACYP17A1PDE4B
SCHEMBL5205885 0.73 HIF1A (0.45) PDE4B
SCHEMBL5207081 0.71 CYP17A1 (0.39) SCN9AFYNCYP17A1PDE4B

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 KDM1A 2363/4885SCN9A 1642/4885FYN 1448/4885

“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.