SCHEMBL23518503

SCHEMBL23518503

CCCC(=O)NC1CC2(C1)CC(NC(=O)CC(C)(C)C)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
HSD11B1 P28845 4/20 0.35
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
HPGD P15428 2/20 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
SCHEMBL18969609 0.76 HSD11B1 (0.38) GAAHSD11B1HPGDMEN1MAPT
SCHEMBL20129894 0.75 GAA (0.39) GAAHSD11B1HPGDMEN1MAPT
SCHEMBL18177854 0.73 GAA (0.59) GAAMEN1ALDH1A1MAPTKMT2A
SCHEMBL1515374 0.73 HSD11B1 (0.54) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL23518575 0.73 HSD11B1 (0.54) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL23518502 0.73 HSD11B1 (0.54) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL20467895 0.72 GAA (0.44) GAAL3MBTL1HSD11B1MEN1MAPT
SCHEMBL4094277 0.71 GAA (0.65) GAAMEN1MAPTKMT2A
SCHEMBL20581686 0.70 SMN1; SMN2 (0.56) L3MBTL1MTNR1AMTNR1BHDAC3HDAC1
SCHEMBL5988081 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210179665-A1 COLLECTIONS OF PEPTIDES, PEPTIDE AGENTS, AND METHODS OF USE THEREOF PARABILIS MEDICINES, INC. 2021-06-17 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-20210179665-A1 COLLECTIONS OF PEPTIDES, PEPTIDE AGENTS, AND METHODS OF USE THEREOF IAPP, VIP, NGLY1 GAA 1651/4885L3MBTL1 947/4885MTNR1A 4220/4885

“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.