SCHEMBL5225674

SCHEMBL5225674

CC(C)(C)OC(=O)N1CC[C@H](NC(=O)OCc2ccccc2)[C@@H](c2ccc(F)cc2)C1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.51
P2RX7 Q99572 1/20 0.46
TACR1 P25103 1/20 0.46
GPR119 Q8TDV5 2/20 0.46
RORC P51449 2/20 0.45
HSD11B1 P28845 1/20 0.44
TP53 P04637 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
STS P08842 1/20 0.43
CTSK P43235 1/20 0.43
L3MBTL1 Q9Y468 1/20 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
SCHEMBL5444435 1.00 PDE4B (0.51) PDE4BP2RX7TACR1GPR119RORC
SCHEMBL5444431 1.00 PDE4B (0.51) PDE4BP2RX7TACR1GPR119RORC
SCHEMBL19893581 0.93 PDE4B (0.52) PDE4BTACR1GPR119RORCHSD11B1
SCHEMBL19893583 0.93 PDE4B (0.52) PDE4BTACR1GPR119RORCHSD11B1
SCHEMBL19893582 0.93 PDE4B (0.52) PDE4BTACR1GPR119RORCHSD11B1
SCHEMBL5227765 0.87 GPR119 (0.47) PDE4BP2RX7TACR1GPR119RORC
SCHEMBL5221681 0.87 GPR119 (0.47) PDE4BP2RX7TACR1GPR119RORC
SCHEMBL5226606 0.87 GPR119 (0.47) PDE4BP2RX7TACR1GPR119RORC
SCHEMBL4483683 0.86 P2RX7 (0.47) P2RX7GPR119RORCHSD11B1TP53
SCHEMBL4483688 0.86 P2RX7 (0.47) P2RX7GPR119RORCHSD11B1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244158-A1 Piperdine Compound and Process for Preparing the Same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-10-18 US disclosed
EP-1789389-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2007-05-30 EP disclosed
WO-2006030984-A1 PIPERIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2006-03-23 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 (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-20070244158-A1 Piperdine Compound and Process for Preparing the Same AVPR1B, PRLHR, HRH4 PDE4B 1273/4885P2RX7 264/4885TACR1 12/4885

“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.