SCHEMBL6718478

SCHEMBL6718478

COc1ccc(N2CCN(C(=O)Nc3ccc(OC)c(C4CCN(C(C)C)CC4)c3)CC2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ HTR1A P08908 9/20 0.49
▸ HTR1D P28221 9/20 0.49
▸ HTR1B P28222 9/20 0.49
▸ HTR2A P28223 5/20 0.48
▸ HTR2C P28335 4/20 0.48
▸ HTR6 P50406 3/20 0.48
▸ NAMPT P43490 2/20 0.47
▸ SHMT2 P34897 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
SCHEMBL6714888 0.92 MAPT (0.48) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6717567 0.91 MAPT (0.58) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6714737 0.91 HTR1A (0.61) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6724719 0.91 HTR1A (0.52) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6717896 0.90 HTR1A (0.61) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6718825 0.90 HTR1A (0.47) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6717719 0.90 HTR1A (0.52) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6714948 0.89 CA12 (0.55) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL6716499 0.89 PANK3 (0.58) MAPTHTR1AHTR1DHTR1BHTR2A
SCHEMBL6715062 0.88 PANK3 (0.56) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313477-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2004-03-03 — — EP claimed
US-20040038982-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2004-02-26 — — US claimed
EP-1313477-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2003-05-28 — — EP claimed
WO-2002005819-A1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2002-01-24 — — WO claimed
EP-1313477-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2004-03-03 — — EP disclosed
US-20040038982-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2004-02-26 — — US disclosed
EP-1313477-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2003-05-28 — — EP disclosed
WO-2002005819-A1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2002-01-24 — — 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-20040038982-A1 Compounds and methods CCR5, CXCR3, CCR2 MAPT 1705/4885SMN1; SMN2 3508/4885MEN1 4489/4885

“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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