SCHEMBL5286937

SCHEMBL5286937

CC(C)(C)OC(=O)N1CC[C@H](Oc2ccc(CCCNC(=O)COCc3ccc(F)cc3)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.42
EPHX2 P34913 1/20 0.42
S1PR3 Q99500 1/20 0.42
FFAR4 Q5NUL3 2/20 0.41
USP30 Q70CQ3 1/20 0.40
GPR119 Q8TDV5 5/20 0.40
CCR3 P51677 1/20 0.39
HTR2A P28223 1/20 0.38

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
SCHEMBL5278229 1.00 CCR1 (0.42) CCR1EPHX2S1PR3FFAR4USP30
SCHEMBL5278232 1.00 CCR1 (0.42) CCR1EPHX2S1PR3FFAR4USP30
SCHEMBL5279858 0.82 GPR119 (0.44) GPR119
SCHEMBL5281643 0.82 GPR119 (0.49) GPR119
SCHEMBL3377761 0.80 GPR119 (0.57) USP30GPR119
SCHEMBL19838626 0.80 GPR119 (0.57) USP30GPR119
SCHEMBL5287840 0.78 NAMPT (0.41) GPR119
SCHEMBL5534425 0.78 GPR119 (0.55) USP30GPR119
SCHEMBL5280890 0.76 SLC6A2 (0.40) CCR1EPHX2FFAR4
SCHEMBL5280898 0.76 SLC6A2 (0.40) CCR1EPHX2FFAR4

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
EP-1863804-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2007-12-12 EP claimed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US claimed
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO claimed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 CCR1 4083/4885EPHX2 2053/4885S1PR3 1289/4885

“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.