SCHEMBL5662477

SCHEMBL5662477

CCO[C@@H]1CCCN(C[C@H]2CCCC[C@@H]2NC(=O)c2ccc(SCC)nc2)C1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DGAT2 Q96PD7 3/20 0.39
▸ VNN1 O95497 1/20 0.38
▸ CCR3 P51677 11/20 0.36
▸ EGLN1 Q9GZT9 1/20 0.36

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
SCHEMBL14392772 1.00 DGAT2 (0.39) DGAT2VNN1CCR3EGLN1
SCHEMBL14368773 0.86 HPGDS (0.41) CCR3EGLN1
SCHEMBL5661805 0.85 HPGDS (0.47) DGAT2EGLN1
SCHEMBL5661625 0.78 HRH2 (0.41) VNN1CCR3
SCHEMBL5669369 0.78 HRH2 (0.41) VNN1CCR3
SCHEMBL5669362 0.78 HRH2 (0.41) VNN1CCR3
SCHEMBL14392360 0.78 HRH2 (0.41) VNN1CCR3
SCHEMBL5662634 0.75 CCR3 (0.40) CCR3
SCHEMBL4426712 0.73 ACKR3 (0.47) EGLN1
SCHEMBL14368706 0.73 ACKR3 (0.47) EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — US claimed
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — US disclosed
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — US disclosed
US-20070259888-A1 Novel Compounds ASTRAZENECA AB (SE) 2007-11-08 — — 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-20070259888-A1 Novel Compounds OPRL1, OPRM1, SIGMAR1 DGAT2 4460/4885VNN1 4189/4885CCR3 247/4885

“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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