SCHEMBL6339546

SCHEMBL6339546

CN(CCCc1ccc(Cl)cc1Cl)c1nc(Cl)nc(N(C)CCc2ccc(O)cc2)n1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 17/20 0.56
▸ ESR1 P03372 15/20 0.56
▸ POLB P06746 1/20 0.43
▸ IDO1 P14902 1/20 0.41

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
SCHEMBL6337298 0.87 ESR2 (0.53) ESR2ESR1
SCHEMBL6339545 0.86 ESR2 (0.57) ESR2ESR1POLB
SCHEMBL6335719 0.84 ESR1 (0.80) ESR2ESR1
SCHEMBL6337734 0.80 ESR2 (0.50) ESR2ESR1
SCHEMBL6337118 0.75 AOC3 (0.46) ESR2ESR1
SCHEMBL6337297 0.74 ESR2 (0.52) ESR2ESR1
SCHEMBL6343463 0.73 ESR2 (0.69) ESR2ESR1
SCHEMBL6335716 0.73 ESR1 (0.79) ESR2ESR1
SCHEMBL28490760 0.72 IDO1 (0.58) ESR2ESR1POLBIDO1
SCHEMBL6342340 0.71 ESR2 (0.78) ESR2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6943162-B2 Osteoporosis; cardiovascular disorders; anticancer agents;incontinence SMITHKLINE BEECHAM CORPORATION (US) 2005-09-13 — — US disclosed
US-20040072829-A1 Piperazinyltriazines as estrogen receptor modulators SMITHKLINE BEECHAM CORPORATION 2004-04-15 — — 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-20040072829-A1 Piperazinyltriazines as estrogen receptor modulators GPER1, ESR2, ESR1 ESR2 2/4885ESR1 3/4885POLB 3259/4885

“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.

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