SCHEMBL3579083

SCHEMBL3579083

NCC[CH]COCc1ccccc1C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PARP1 P09874 2/20 0.35
PARP10 Q53GL7 3/20 0.35
PARP15 Q460N3 2/20 0.35
PARP14 Q460N5 2/20 0.35
MAOB P27338 1/20 0.35
METAP2 P50579 1/20 0.34
CTNNB1 P35222 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
AKR1C1 Q04828 1/20 0.33
BCAT2 O15382 1/20 0.33
AKR1C3 P42330 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL3577605 0.92 MEN1 (0.37) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL3591420 0.90 MEN1 (0.36) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL3591721 0.81 MEN1 (0.37) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL3893971 0.80 MEN1 (0.41) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL3580531 0.79 KDM4E (0.44) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL3585495 0.78 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL4981766 0.78 KDM4E (0.42) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL3586818 0.77 ALDH1A1 (0.35) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL5759430 0.77 MEN1 (0.39) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL3583573 0.76 KDM4E (0.37) MEN1KMT2AKDM4EALDH1A1HPGD

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 MEN1 488/4885KMT2A 2996/4885KDM4E 1818/4885

“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.