SCHEMBL2137111

SCHEMBL2137111

CCCCC(=O)N1CCOC(c2ccccc2)C1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
HPGD P15428 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPK1 P28482 2/20 0.43
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
DRD3 P35462 3/20 0.43
FKBP1A P62942 1/20 0.41
CNR2 P34972 2/20 0.40
KDM1A O60341 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL2133733 0.96 USP30 (0.47) USP30MAPTMEN1KMT2APOLB
SCHEMBL2133873 0.92 USP30 (0.49) USP30MAPTMEN1KMT2APOLB
SCHEMBL14035660 0.87 USP30 (0.51) USP30MEN1KMT2APOLBALDH1A1
SCHEMBL25517300 0.85 GLA (0.53) USP30MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL2131359 0.83 FKBP1A (0.62) USP30MAPTMEN1KMT2APOLB
SCHEMBL2133807 0.81 USP30 (0.51) USP30MEN1KMT2APOLBALDH1A1
SCHEMBL2132316 0.81 USP30 (0.48) USP30MEN1KMT2APOLBSMN1; SMN2
SCHEMBL2132155 0.80 SMN1; SMN2 (0.66) MAPTMEN1KMT2APOLBSMN1; SMN2
SCHEMBL2133127 0.80 PDE4B (0.41) USP30SMN1; SMN2DRD3
SCHEMBL25453440 0.79 USP30 (0.54) USP30MEN1KMT2APOLBDRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912329-B2 Composition for treatment of tuberculosis BioVersys AG (CH) 2014-12-16 US disclosed
US-8912329-B2 Composition for treatment of tuberculosis BioVersys AG (CH) 2014-12-16 US disclosed
US-8912329-B2 Composition for treatment of tuberculosis BioVersys AG (CH) 2014-12-16 US disclosed
EP-2445495-A1 COMPOSITION FOR TREATMENT OF TUBERCULOSIS Bioversys AG (CH) 2012-05-02 EP disclosed
US-20120101080-A1 COMPOSITION FOR TREATMENT OF TUBERCULOSIS BioVersys AG (CH) 2012-04-26 US disclosed
US-20120101080-A1 COMPOSITION FOR TREATMENT OF TUBERCULOSIS BioVersys AG (CH) 2012-04-26 US disclosed
US-20120101080-A1 COMPOSITION FOR TREATMENT OF TUBERCULOSIS BioVersys AG (CH) 2012-04-26 US disclosed
WO-2010149761-A1 COMPOSITION FOR TREATMENT OF TUBERCULOSIS BIOVERSYS GMBH (CH) 2010-12-29 WO disclosed
WO-2010149761-A1 COMPOSITION FOR TREATMENT OF TUBERCULOSIS BIOVERSYS GMBH (CH) 2010-12-29 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-20120101080-A1 COMPOSITION FOR TREATMENT OF TUBERCULOSIS PRMT7, NCOA3, PRMT3 USP30 3636/4885MAPT 2520/4885MEN1 971/4885

“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.