SCHEMBL5239082

SCHEMBL5239082

CC(C)(C)[SiH](Oc1cc(CO)cc(CO)c1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.36
TSHR P16473 2/20 0.35
TTR P02766 1/20 0.34
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
GPBAR1 Q8TDU6 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP4F2 P78329 2/20 0.30
CYP4A11 Q02928 2/20 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
SCHEMBL706107 0.77 CA4 (0.37) LTA4HTSHR
SCHEMBL5008068 0.68 GSK3B (0.45)
SCHEMBL9481670 0.68 ALDH1A1 (0.44) TSHRSMN1; SMN2
SCHEMBL10516808 0.67 MAPK1 (0.37)
SCHEMBL5232509 0.66 LTA4H (0.36) LTA4HTSHRTTRPPARGPPARA
SCHEMBL705887 0.66 MAPK1 (0.36) LTA4H
SCHEMBL713132 0.65 RELA (0.33) LTA4HTSHR
SCHEMBL704633 0.64 MAPK1 (0.34) TSHR
SCHEMBL3271153 0.64 CYP4F2 (0.61) LTA4HTSHRSMN1; SMN2CYP4F2CYP4A11
SCHEMBL21228666 0.64 PDK1 (0.32) TSHRSMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1403250-B1 BIS(5-ARYL-2-PYRIDYL) DERIVATIVE KOWA CO (JP) 2007-07-18 EP disclosed
US-7196101-B2 Bis(5-aryl-2-pyridyl) compound having excellent immunoglobulin (IgE) antibody production inhibiting activity, useful for the prevention or treatment of allergic immune diseases KOWA CO., LTD (JP) 2007-03-27 US disclosed
US-20050101634-A1 Bis(5-aeyl-2-pyridyl) derivatives KOWA CO., LTD. (JP) 2005-05-12 US disclosed
EP-1403250-A1 BIS(5-ARYL-2-PYRIDYL) DERIVATIVE Kowa Co., Ltd. (JP) 2004-03-31 EP disclosed
US-6706703-B2 BIS(5-ARYL-2-PYRIDYL) COMPOUND HAVING EXCELLENT IMMUNOGLOBULIN (IGE) ANTIBODY PRODUCTION INHIBITING ACTIVITY, USEFUL FOR THE PREVENTION OR TREATMENT OF ALLERGIC IMMUNE DISEASES KOWA CO., LTD. (JP) 2004-03-16 US disclosed
US-20030027814-A1 Bis(5-aryl-2-pyridyl) derivatives KOWA CO., LTD. (JP) 2003-02-06 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 (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-20050101634-A1 Bis(5-aeyl-2-pyridyl) derivatives H1-0, BRD4, PAH LTA4H 4525/4885TSHR 3525/4885TTR 868/4885
US-20030027814-A1 Bis(5-aryl-2-pyridyl) derivatives AHR, PAH, H1-0 LTA4H 4213/4885TSHR 1717/4885TTR 272/4885

“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.