SCHEMBL5138692

SCHEMBL5138692

Cc1ccccc1[C@@H]1CCc2c(C(=O)ON(C)C)cc3c(nc(C)n3C)c2O1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC8A1 P32418 13/20 0.33
BRD4 O60885 1/20 0.30
CREBBP Q92793 1/20 0.30

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
SCHEMBL2689406 0.88 SLC8A1 (0.32) SLC8A1
SCHEMBL4756646 0.86 SLC8A1 (0.33) SLC8A1
SCHEMBL4965120 0.85 BRD4 (0.35) SLC8A1BRD4
SCHEMBL4964547 0.83 HTT (0.38) SLC8A1
SCHEMBL4962494 0.83 KMT2A (0.37) SLC8A1
SCHEMBL4964116 0.83 RAB9A (0.36) SLC8A1
SCHEMBL4962487 0.83 KMT2A (0.37) SLC8A1
SCHEMBL4964550 0.83 HTT (0.38) SLC8A1
SCHEMBL4574531 0.82 SLC8A1 (0.40) SLC8A1
SCHEMBL4590624 0.82 SLC8A1 (0.34) SLC8A1

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-20080280855-A1 Process For the Production of Intermediates For the Preparation of Tricyclic Benzimidazoles NYCOMED GMBH (DE) 2008-11-13 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-20080280855-A1 Process For the Production of Intermediates For the Preparation of Tricyclic Benzimidazoles CYP1B1, CYP1A1, CYP3A4 SLC8A1 4475/4885BRD4 366/4885CREBBP 1935/4885

“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.