SCHEMBL6337298

SCHEMBL6337298

CN(CCCc1ccc(Cl)cc1)c1nc(Cl)nc(N(C)CCc2ccc(O)cc2)n1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 20/20 0.53
▸ ESR1 P03372 18/20 0.53

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
SCHEMBL6337734 0.90 ESR2 (0.50) ESR2ESR1
SCHEMBL6337118 0.87 AOC3 (0.46) ESR2ESR1
SCHEMBL6339546 0.87 ESR2 (0.56) ESR2ESR1
SCHEMBL6343463 0.85 ESR2 (0.69) ESR2ESR1
SCHEMBL6337297 0.83 ESR2 (0.52) ESR2ESR1
SCHEMBL6342340 0.82 ESR2 (0.78) ESR2ESR1
SCHEMBL6342320 0.81 ESR1 (0.78) ESR2ESR1
SCHEMBL6334135 0.80 ESR2 (0.78) ESR2ESR1
SCHEMBL6333141 0.79 ESR2 (0.79) ESR2ESR1
SCHEMBL6336674 0.76 TAAR1 (0.46) 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 3 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
WO-2002072561-A1 PIPERAZINYLTRIAZINES AS ESTROGEN RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2002-09-19 — — 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-20040072829-A1 Piperazinyltriazines as estrogen receptor modulators GPER1, ESR2, ESR1 ESR2 2/4885ESR1 3/4885

“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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