SCHEMBL4938707

SCHEMBL4938707

COC(=O)C1=C(c2ccc(CCCO[Si](C)(C)C(C)(C)C)cc2)C(C)(C)CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 4/20 0.37
PKM P14618 1/20 0.35
GPR119 Q8TDV5 7/20 0.33
PTPN2 P17706 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
SLC2A1 P11166 1/20 0.32
RORC P51449 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL4939372 0.90 PKM (0.36) NR1H2PKMGPR119PTPN2PTPN1
SCHEMBL4941222 0.87 NR1H2 (0.43) NR1H2PKMGPR119PTPN2PTPN1
SCHEMBL3085985 0.82 CHRM5 (0.41) NR1H2PKMHDAC1HDAC6
SCHEMBL4937394 0.82 REN (0.46)
SCHEMBL4941012 0.77 NR1H2 (0.43) NR1H2PKMGPR119RORCHDAC1
SCHEMBL3096155 0.75 CHRM5 (0.39) NR1H2GPR119HDAC1HDAC6
SCHEMBL4930538 0.73 REN (0.45) RORC
SCHEMBL4932897 0.73 REN (0.46)
SCHEMBL3044833 0.69 CHRM5 (0.43) NR1H2PKMGPR119
SCHEMBL4934280 0.69 NR1H2 (0.41) NR1H2GPR119RORC

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-20080234305-A1 Novel Tetrahydropyridine Derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2008-09-25 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-20080234305-A1 Novel Tetrahydropyridine Derivatives REN, AGTR1, CBR1 NR1H2 797/4885PKM 390/4885GPR119 84/4885

“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.