SCHEMBL5573746

SCHEMBL5573746

O=C(O)C1CCC(Oc2ccc(CBr)cn2)CC1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 16/20 0.51
SOAT1 P35610 2/20 0.44
KCNH2 Q12809 1/20 0.44
ACSL1 P33121 2/20 0.43
ACACB O00763 2/20 0.42

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
SCHEMBL4598307 0.85 KMT2A (0.48) DGAT1ACACB
SCHEMBL30356841 0.82 DGAT1 (0.50) DGAT1SOAT1KCNH2ACSL1
SCHEMBL1588860 0.82 DGAT1 (0.50) DGAT1SOAT1KCNH2ACSL1
SCHEMBL25074385 0.82 DGAT1 (0.50) DGAT1SOAT1KCNH2ACSL1
SCHEMBL1588861 0.82 DGAT1 (0.50) DGAT1SOAT1KCNH2ACSL1
SCHEMBL25196581 0.82 DGAT1 (0.50) DGAT1SOAT1KCNH2ACSL1
SCHEMBL25204122 0.79 DGAT1 (0.50) DGAT1SOAT1KCNH2ACSL1
SCHEMBL15152818 0.79 DGAT1 (0.58) DGAT1SOAT1KCNH2
SCHEMBL3690947 0.79 DGAT1 (0.50) DGAT1SOAT1KCNH2ACSL1
SCHEMBL15152822 0.79 DGAT1 (0.58) DGAT1SOAT1KCNH2

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-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 DGAT1 2918/4885SOAT1 3619/4885KCNH2 4762/4885

“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.