SCHEMBL3248013

SCHEMBL3248013

C=CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C1COC(C)(C)O1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.33
EPHX1 P07099 1/20 0.32
NR1H2 P55055 1/20 0.32
USP30 Q70CQ3 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
GPR119 Q8TDV5 1/20 0.31
PIK3CD O00329 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
SCHEMBL3251687 0.91 RECQL (0.37) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL3246475 0.85 RECQL (0.38) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL3239792 0.85 RECQL (0.36) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL3252656 0.84 RECQL (0.37) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL5454378 0.81 RECQL (0.36) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL5224218 0.78 HPGD (0.40) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL709070 0.74 PDE4B (0.42) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL14031173 0.73 HPGD (0.42) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL18814077 0.71 NR1H2 (0.46) RECQLMEN1ALDH1A1MAPTKMT2A
SCHEMBL18814079 0.71 NR1H2 (0.46) RECQLMEN1ALDH1A1MAPTKMT2A

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 RECQL 2636/4885MEN1 4025/4885ALDH1A1 2606/4885

“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.