SCHEMBL1920229

SCHEMBL1920229

O=C(O)Cn1ccc2cc(N3CCN(C(=O)OCC4c5ccccc5-c5ccccc54)CC3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
HTR6 P50406 1/20 0.41
PDK2 Q15119 1/20 0.39
SSTR1 P30872 3/20 0.38
SSTR2 P30874 3/20 0.38
SSTR4 P31391 3/20 0.38
SSTR3 P32745 3/20 0.38
CYP2D6 P10635 2/20 0.38
DRD2 P14416 2/20 0.38
DRD4 P21917 2/20 0.38
PPARD Q03181 2/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL1920866 0.86 KDM4E (0.46) KMT2APDK2SSTR1SSTR2SSTR4
SCHEMBL18130555 0.78 GAA (0.47)
SCHEMBL8365081 0.77 TMEM97 (0.41) PDK2SSTR1SSTR2SSTR4SSTR3
SCHEMBL3049159 0.77 KDM4E (0.42) KMT2APDK2SSTR1SSTR2SSTR4
SCHEMBL4652078 0.76 MAPT (0.46) KMT2APDK2SSTR1SSTR3MAPT
SCHEMBL1920805 0.76 PDK2 (0.40) PDK2SSTR1SSTR2SSTR4SSTR3
SCHEMBL31505489 0.76 KDM4E (0.46) KMT2ACYP2D6MAPT
SCHEMBL119822 0.76 KDM4E (0.46) KMT2ACYP2D6MAPT
SCHEMBL31398326 0.76 KDM4E (0.46) KMT2ACYP2D6MAPT
SCHEMBL30481198 0.76 KDM4E (0.46) KMT2ACYP2D6MAPT

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-8299023-B2 Neuropeptide-2 receptor (Y-2R) agonists HOFFMANN-LA ROCHE INC. (US) 2012-10-30 US disclosed
US-8299023-B2 Neuropeptide-2 receptor (Y-2R) agonists HOFFMANN-LA ROCHE INC. (US) 2012-10-30 US disclosed
US-8299023-B2 Neuropeptide-2 receptor (Y-2R) agonists HOFFMANN-LA ROCHE INC. (US) 2012-10-30 US disclosed
EP-2326666-A1 NEUROPEPTIDE-2 RECEPTOR (Y-2R) AGONISTS AND USES THEREOF F. Hoffmann-La Roche AG (CH) 2011-06-01 EP disclosed
WO-2010031707-A1 NEUROPEPTIDE-2 RECEPTOR (Y-2R) AGONISTS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2010-03-25 WO disclosed
WO-2010031707-A1 NEUROPEPTIDE-2 RECEPTOR (Y-2R) AGONISTS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2010-03-25 WO disclosed
US-20100069307-A1 NEUROPEPTIDE-2 RECEPTOR (Y-2R) AGONISTS DANHO WALEED 2010-03-18 US disclosed
US-20100069307-A1 NEUROPEPTIDE-2 RECEPTOR (Y-2R) AGONISTS DANHO WALEED 2010-03-18 US disclosed
US-20100069307-A1 NEUROPEPTIDE-2 RECEPTOR (Y-2R) AGONISTS DANHO WALEED 2010-03-18 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-20100069307-A1 NEUROPEPTIDE-2 RECEPTOR (Y-2R) AGONISTS NPY2R, NPY1R, NPY4R KMT2A 2741/4885HTR6 439/4885PDK2 2749/4885

“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.