SCHEMBL5579900

SCHEMBL5579900

Oc1ccc(-c2nc3cc(O)ccc3n2-c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.68
ESR2 Q92731 4/20 0.68
GRIA1 P42261 1/20 0.62
CACNG8 Q8WXS5 1/20 0.62
CACNG2 Q9Y698 1/20 0.62
SIRT2 Q8IXJ6 2/20 0.53
SIRT1 Q96EB6 2/20 0.53
ALDH1A1 P00352 3/20 0.52
GAA P10253 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LMNA P02545 1/20 0.49
FGFR1 P11362 1/20 0.48
MAPK10 P53779 1/20 0.47
RAD51 Q06609 1/20 0.47
PTGER4 P35408 1/20 0.46
HSD17B10 Q99714 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
SCHEMBL5580001 0.88 ESR2 (0.68) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL8021778 0.88 ESR2 (0.88) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL2327451 0.87 ESR1 (0.68) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL10047632 0.86 ESR2 (0.85) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL2328330 0.83 ESR2 (0.70) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL6440249 0.83 ESR2 (0.91) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL9007262 0.83 ESR2 (0.91) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL6701015 0.81 SIRT2 (0.68) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL6440186 0.81 ESR2 (1.00) ESR1ESR2GRIA1CACNG8CACNG2
SCHEMBL13486686 0.81 SIRT2 (0.62) ESR1ESR2GRIA1CACNG8CACNG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070004713-A1 Therapeutic benimidazole compounds ASTRAZENECA AB (SE) 2007-01-04 US disclosed
EP-1341768-A1 THERAPEUTIC BENZIMIDAZOLE COMPOUNDS AstraZeneca AB (SE) 2003-09-10 EP disclosed
WO-2002046168-A1 THERAPEUTIC BENZIMIDAZOLE COMPOUNDS ASTRAZENECA AB (SE) 2002-06-13 WO 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-20070004713-A1 Therapeutic benimidazole compounds ESR2, ESRRA, ESRRB ESR1 6/4885ESR2 1/4885GRIA1 115/4885

“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.