SCHEMBL6419636

SCHEMBL6419636

Oc1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4ccccc4c3)n2)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 11/20 0.55
ESR1 P03372 10/20 0.55
CYP1A2 P05177 2/20 0.52
HSD17B1 P14061 2/20 0.51
HSD17B2 P37059 2/20 0.51
ALOX5 P09917 3/20 0.49
MIF P14174 1/20 0.46
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2B6 P20813 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL13851833 0.88 HSD17B1 (0.47) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL24431730 0.85 FTO (0.47) ESR2ESR1
SCHEMBL15908090 0.85 TSHR (0.58) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL632019 0.84 ESR2 (0.72) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL494006 0.83 ALOX5 (0.60) ESR2ESR1ALOX5
SCHEMBL29740228 0.83 ALOX5 (0.60) ESR2ESR1ALOX5
SCHEMBL29649729 0.82 ALOX5 (0.64) ESR2ESR1ALOX5
SCHEMBL1243192 0.82 ALOX5 (0.64) ESR2ESR1ALOX5
SCHEMBL29649804 0.82 ALOX5 (0.64) ESR2ESR1ALOX5
SCHEMBL6563798 0.82 ALOX5 (0.64) ESR2ESR1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050169859-A1 Naphthyltriazines as stabilizers for organic material TOAN VIEN V (CH) 2005-08-04 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-20050169859-A1 Naphthyltriazines as stabilizers for organic material POT1, H1-2, TYR ESR2 626/4885ESR1 1006/4885CYP1A2 39/4885

“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.