SCHEMBL16017641

SCHEMBL16017641

C[C@@H](Cc1cccc2ccccc12)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.59
KDM4E B2RXH2 2/20 0.56
APAF1 O14727 1/20 0.56
POLB P06746 1/20 0.56
MAPT P10636 1/20 0.56
RECQL P46063 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
TDP1 Q9NUW8 2/20 0.56
MMP9 P14780 2/20 0.55
MMP8 P22894 1/20 0.55
MMP14 P50281 1/20 0.55
MME P08473 2/20 0.54
ACE P12821 2/20 0.54
CPA1 P15085 1/20 0.54
ACE2 Q9BYF1 1/20 0.54
HRH4 Q9H3N8 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 1/20 0.49
SLC1A3 P43003 1/20 0.49
SLC1A2 P43004 1/20 0.49

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
SCHEMBL6907446 1.00 CTNNB1 (0.59) CTNNB1KDM4EAPAF1POLBMAPT
SCHEMBL25846959 1.00 CTNNB1 (0.59) CTNNB1KDM4EAPAF1POLBMAPT
SCHEMBL3146178 0.87 KDM4E (0.51) CTNNB1KDM4EAPAF1POLBMAPT
SCHEMBL10421147 0.87 CTNNB1 (0.54) CTNNB1KDM4EAPAF1POLBMAPT
SCHEMBL16743938 0.86 CTNNB1 (0.55) CTNNB1KDM4EL3MBTL1TDP1MMP9
SCHEMBL6623784 0.86 CTNNB1 (0.55) CTNNB1KDM4EL3MBTL1TDP1MMP9
SCHEMBL13879137 0.86 CTNNB1 (0.55) CTNNB1KDM4EL3MBTL1TDP1MMP9
SCHEMBL8874713 0.85 CTNNB1 (0.54) CTNNB1KDM4EL3MBTL1TDP1MMP9
SCHEMBL1284854 0.85 CTNNB1 (0.54) CTNNB1L3MBTL1TDP1MMP9MMP8
SCHEMBL7272663 0.84 CTNNB1 (0.75) CTNNB1MAPTTDP1MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11859014-B2 Peptidomimetics for the treatment of Norovirus infection EMORY UNIVERSITY (US) 2024-01-02 US disclosed
US-11814444-B2 Cyclic polypeptides for PCSK9 inhibition RA PHARMACEUTICALS, INC. (US) 2023-11-14 US disclosed
WO-2022148843-A1 COMPOUNDS COMPRISING A FIBROBLAST ACTIVATION PROTEIN LIGAND AND USE THEREOF 3B PHARMACEUTICALS GMBH (DE) 2022-07-14 WO disclosed
US-20140256912-A1 Stabilized Variant MAML Peptides and Uses Thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-09-11 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 (3 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-11859014-B2 Peptidomimetics for the treatment of Norovirus infection VIP, HAVCR2, NGLY1 CTNNB1 2641/4885KDM4E 3724/4885APAF1 775/4885
US-20140256912-A1 Stabilized Variant MAML Peptides and Uses Thereof NOTCH1, MDN1, NOTCH2 CTNNB1 1697/4885KDM4E 3647/4885APAF1 1137/4885
US-11814444-B2 Cyclic polypeptides for PCSK9 inhibition PCSK9, LDLR, PCSK7 CTNNB1 1375/4885KDM4E 4154/4885APAF1 540/4885

“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.