SCHEMBL3583373

SCHEMBL3583373

NCC[CH]C(=O)NCc1ccccc1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 7/20 0.38
KDM4E B2RXH2 5/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPK8 P45983 3/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTT P42858 1/20 0.35
NAMPT P43490 1/20 0.35
RCE1 Q9Y256 1/20 0.35
AURKA O14965 1/20 0.35
RPS6KB1 P23443 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
F2RL1 P55085 1/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTR2A P28223 1/20 0.34

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
SCHEMBL13516667 0.85 GAA (0.40) GAAKMT2AHPGDKDM4EALDH1A1
SCHEMBL3587752 0.77 HTR2A (0.39) KMT2AHPGDKDM4EALDH1A1MAPK8
SCHEMBL14861310 0.75 LMNA (0.50) GAAKMT2AHPGDKDM4EALDH1A1
SCHEMBL28984805 0.74 SETDB1 (0.49) HPGDKDM4EALDH1A1MAPK8MAPT
Hydrochloric Acid SCHEMBL20487425 0.73 HPGD (0.42) GAAKMT2AHPGDKDM4EALDH1A1
SCHEMBL6156971 0.73 MAPK8 (0.43) GAAKMT2AHPGDKDM4EALDH1A1
SCHEMBL3585495 0.72 KDM4E (0.40) GAAKMT2AHPGDKDM4EALDH1A1
SCHEMBL4422142 0.72 NPC1 (0.46) GAAKMT2AHPGDKDM4EALDH1A1
SCHEMBL5023431 0.71 SLC6A5 (0.36) HPGDKDM4EALDH1A1MAPK8MAPT
SCHEMBL3592882 0.71 ALDH1A1 (0.39) GAAKMT2AHPGDKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 Wurster, Siegfried (FI) 2010-02-25 US disclosed
EP-1885693-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 Wurster, Siegfried (FI) 2008-02-13 EP disclosed
WO-2006123020-A1 PEPTIDOMIMETICS SELECTIVE FOR THE SOMATOSTATIN RECEPTOR SUBTYPES 1 AND/OR 4 JUVANTIA PHARMA LTD OY (FI) 2006-11-23 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-20100048549-A1 Peptidomimetics selective for the somatostatin receptor subtypes 1 and/or 4 SSTR1, SSTR4, SSTR3 GAA 3279/4885KMT2A 2996/4885HPGD 4277/4885

“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.