SCHEMBL4154682

SCHEMBL4154682

Nc1c(Br)cccc1C1C=CCCC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.32

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
SCHEMBL9627029 0.81 CD44 (0.37)
SCHEMBL18255662 0.77 ALDH1A1 (0.33)
SCHEMBL9051200 0.76 KDM4E (0.33)
SCHEMBL12992731 0.76 KDM4E (0.33)
Hydrochloric Acid SCHEMBL6384484 0.74 KDM1A (0.35) KDM1A
SCHEMBL28586804 0.73 CD44 (0.33)
SCHEMBL16755274 0.72 ALDH1A1 (0.42) KDM1A
SCHEMBL21526245 0.70 HTR2C (0.38) KDM1A
SCHEMBL5404231 0.70 KDM1A (0.43) KDM1A
SCHEMBL20561573 0.69 HTR2C (0.42) KDM1A

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
US-7622494-B2 Chemical compounds SMITHKLINE BEECHAM CORPORATION (US) 2009-11-24 US disclosed
US-20090170923-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
EP-1658068-B1 NOVEL CYCLOALKYL[B] CONDENSED INDOLES SMITHKLINE BEECHAM CORP (US) 2009-02-18 EP disclosed
EP-1817026-A2 HCV INHIBITORS SmithKline Beecham Corporation (US) 2007-08-15 EP disclosed
US-20060281804-A1 Novel cycloalkyl'b! condensed indoles SMITHKLINE BEECHAM CORPORATION 2006-12-14 US disclosed
WO-2006121466-A2 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2006-11-16 WO disclosed
EP-1658068-A1 NOVEL CYCLOALKYL'B! CONDENSED INDOLES SMITHKLINE BEECHAM CORPORATION (US) 2006-05-24 EP disclosed
WO-2005023245-A1 NOVEL CYCLOALKYL’B! CONDENSED INDOLES SMITHKLINE BEECHAM CORPORATION (US) 2005-03-17 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 (2 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-20090170923-A1 HCV INHIBITORS HAVCR2, MAVS, EIF2AK2 KDM1A 2788/4885
US-20060281804-A1 Novel cycloalkyl'b! condensed indoles BCCIP, TP53, TOP2B KDM1A 3312/4885

“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.