SCHEMBL3250607

SCHEMBL3250607

CC(C)(C)OC(=O)N1CC[C@@H](CCS(=O)(=O)c2nnnn2-c2ccccc2)[C@@H](CCO[Si](C)(C)C(C)(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.38
STS P08842 1/20 0.38
USP30 Q70CQ3 5/20 0.37
LMNA P02545 3/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
POLB P06746 1/20 0.36
THRB P10828 3/20 0.36
PTPRB P23467 1/20 0.36
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35

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
SCHEMBL3249302 0.83 GPR119 (0.41) GPR119STSUSP30LMNAMAPT
SCHEMBL632936 0.79 GPR119 (0.47) GPR119STSUSP30LMNAMAPT
SCHEMBL20183231 0.76 ALDH1A1 (0.55) LMNAMAPTTP53ALDH1A1HPGD
SCHEMBL2415819 0.74 ALDH1A1 (0.53) LMNAMAPTTP53ALDH1A1HPGD
SCHEMBL2413693 0.73 ALDH1A1 (0.52) LMNAMAPTTP53ALDH1A1HPGD
SCHEMBL1147948 0.71 ALDH1A1 (0.47) LMNAMAPTTP53ALDH1A1HPGD
SCHEMBL5441281 0.70 ALDH1A1 (0.39) GPR119LMNAMAPTTP53ALDH1A1
SCHEMBL3243013 0.70 THRB (0.38) GPR119USP30LMNAMAPTTP53
SCHEMBL3250603 0.68 RECQL (0.39) GPR119USP30MAPTALDH1A1HPGD
SCHEMBL3252633 0.68 RECQL (0.38) GPR119MAPTALDH1A1HPGDTHRB

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-1799674-B1 NEW PIPERIDINE ANTIBIOTICS ACTELION PHARMACEUTICALS LTD (CH) 2010-05-05 EP disclosed
US-20070173532-A1 New Piperidine Antibiotics ACTELION PHARMACEUTICALS LTD. (CH) 2007-07-26 US disclosed
EP-1799674-A1 NEW PIPERIDINE ANTIBIOTICS Actelion Pharmaceuticals Ltd. (CH) 2007-06-27 EP disclosed
WO-2006038172-A1 NEW PIPERIDINE ANTIBIOTICS ACTELION PHARMACEUTICALS LTD (CH) 2006-04-13 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-20070173532-A1 New Piperidine Antibiotics OPRM1, SIGMAR1, CBR3 GPR119 3743/4885STS 1932/4885USP30 1840/4885

“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.