SCHEMBL3103272

SCHEMBL3103272

CON(C)C(=O)C1CCC(c2nnc(-c3ccc(N4CCC(OC)(C5CCCCC5)CC4)cc3)s2)CC1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
TP53 P04637 2/20 0.32
KDM4E B2RXH2 2/20 0.32
HSD17B10 Q99714 2/20 0.32
MAPT P10636 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HRH3 Q9Y5N1 3/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
USP2 O75604 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
SCHEMBL3103265 1.00 ALDH1A1 (0.34) ALDH1A1TP53KDM4EHSD17B10MAPT
SCHEMBL3109514 0.90 HRH3 (0.36) ALDH1A1HSD17B10MAPTNPC1RAB9A
SCHEMBL3109508 0.90 HRH3 (0.36) ALDH1A1HSD17B10MAPTNPC1RAB9A
SCHEMBL13098918 0.89 MAPT (0.35) ALDH1A1TP53MAPTRAB9AHRH3
SCHEMBL13098869 0.88 MAPT (0.37) ALDH1A1KDM4EMAPTNPC1RAB9A
SCHEMBL13098856 0.87 ALDH1A1 (0.38) ALDH1A1TP53KDM4EHSD17B10MAPT
SCHEMBL13098861 0.85 ALDH1A1 (0.36) ALDH1A1TP53KDM4EHSD17B10MAPT
SCHEMBL3110248 0.84 HRH3 (0.34) MAPTHRH3USP2
SCHEMBL13099133 0.83 MAPT (0.35) TP53MAPT
SCHEMBL6134823 0.83 HRH3 (0.38) MAPTSMN1; SMN2HRH3USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256048-A1 POLYPEPTIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-10-07 US disclosed
EP-2204379-A1 POLYPEPTIDE COMPOUND Astellas Pharma Inc. (JP) 2010-07-07 EP 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-20100256048-A1 POLYPEPTIDE COMPOUND VIP, ANPEP, NPEPPS ALDH1A1 4854/4885TP53 3879/4885KDM4E 3427/4885

“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.