SCHEMBL23518447

SCHEMBL23518447

CC(C)CC(=O)N1CCC2(CCN(C(=O)CC(C)(C)C)C2)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.46
OPRL1 P41146 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.43
POLB P06746 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP2D6 P10635 4/20 0.36
CYP3A4 P08684 1/20 0.36
ALDH1A1 P00352 5/20 0.36
CYP2C9 P11712 3/20 0.36
CYP1A2 P05177 3/20 0.36
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MDM2 Q00987 1/20 0.35
TSHR P16473 3/20 0.35
RORC P51449 1/20 0.35
CYP2C19 P33261 2/20 0.35
HIF1A Q16665 2/20 0.34
USP2 O75604 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
SCHEMBL23518495 0.89 RORC (0.39) OPRM1OPRL1CYP2D6CYP3A4ALDH1A1
SCHEMBL15125407 0.84 OPRM1 (0.57) OPRM1OPRL1L3MBTL1POLBNPSR1
SCHEMBL19498061 0.82 OPRM1 (0.46) OPRM1OPRL1L3MBTL1POLBNPSR1
SCHEMBL22900017 0.78 ALDH1A1 (0.35) OPRM1OPRL1CYP2D6CYP3A4ALDH1A1
SCHEMBL22279586 0.78 HSD11B1 (0.37) OPRM1OPRL1ALDH1A1CYP1A2TSHR
SCHEMBL25091528 0.78 POLB (0.44) OPRM1OPRL1L3MBTL1POLBNPSR1
SCHEMBL17531226 0.77 OPRM1 (0.36) OPRM1OPRL1RORC
SCHEMBL23551265 0.76 HRH3 (0.43) OPRM1OPRL1L3MBTL1POLBNPSR1
SCHEMBL9944475 0.76 RORC (0.40) OPRM1CYP3A4ALDH1A1CYP1A2KMT2A
SCHEMBL22900112 0.75 POLB (0.43) OPRM1OPRL1L3MBTL1POLBNPSR1

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 OPRM1 4734/4885OPRL1 4130/4885L3MBTL1 947/4885

“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.