SCHEMBL21645191

SCHEMBL21645191

CC(C)(C)OC(=O)N1CCC(C(F)C(=O)O)C1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.45
DPP4 P27487 1/20 0.44
HPGD P15428 1/20 0.44
MMP13 P45452 4/20 0.44
RECQL P46063 1/20 0.43
EPHX1 P07099 1/20 0.43
PDE4B Q07343 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
USP30 Q70CQ3 1/20 0.41
MMP1 P03956 2/20 0.41
MMP3 P08254 2/20 0.41
MMP7 P09237 2/20 0.41
MMP9 P14780 2/20 0.41
MMP8 P22894 2/20 0.41
MMP2 P08253 1/20 0.41

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
SCHEMBL31510750 0.91 HPGD (0.50) GPR119DPP4HPGDMMP13RECQL
SCHEMBL16338236 0.86 HPGD (0.48) GPR119DPP4HPGDRECQLEPHX1
SCHEMBL16338237 0.86 HPGD (0.48) GPR119DPP4HPGDRECQLEPHX1
SCHEMBL23523667 0.86 HPGD (0.48) GPR119DPP4HPGDRECQLEPHX1
SCHEMBL344483 0.85 HPGD (0.47) GPR119DPP4HPGDMMP13RECQL
SCHEMBL19510778 0.85 HPGD (0.47) GPR119DPP4HPGDMMP13RECQL
SCHEMBL344484 0.85 HPGD (0.47) GPR119DPP4HPGDMMP13RECQL
SCHEMBL13300114 0.84 GPR119 (0.48) GPR119DPP4HPGDMMP13RECQL
SCHEMBL27204263 0.84 GPR119 (0.48) GPR119DPP4HPGDMMP13RECQL
SCHEMBL27157592 0.84 GPR119 (0.48) GPR119DPP4HPGDMMP13RECQL

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-20210300940-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2021-09-30 US disclosed
EP-3830080-A1 TLR7/8 ANTAGONISTS AND USES THEREOF Merck Patent GmbH (DE) 2021-06-09 EP disclosed
CN-112513024-A TLR7/8 antagonists and uses thereof 默克专利股份公司 2021-03-16 CN disclosed
WO-2020025517-A1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2020-02-06 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-20210300940-A1 TLR7/8 ANTAGONISTS AND USES THEREOF TLR7, TLR8, TLR9 GPR119 68/4885DPP4 1190/4885HPGD 3591/4885

“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.