SCHEMBL30799736

SCHEMBL30799736

NC(=O)CC[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.57
MEN1 O00255 1/20 0.57
LMNA P02545 1/20 0.57
MPO P05164 1/20 0.57
MAPT P10636 1/20 0.57
TSHR P16473 1/20 0.57
BLM P54132 1/20 0.57
PMP22 Q01453 1/20 0.57
KMT2A Q03164 1/20 0.57
HIF1A Q16665 1/20 0.57
ECE1 P42892 3/20 0.57
GHSR Q92847 4/20 0.53
CTSC P53634 4/20 0.52
ACE P12821 2/20 0.51
KRAS P01116 1/20 0.50
SOS1 Q07889 1/20 0.50
NPY1R P25929 1/20 0.49
NPY2R P49146 1/20 0.49
NPY4R P50391 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
SCHEMBL21641798 0.92 KDM4E (0.62) KDM4EMEN1LMNAMPOMAPT
SCHEMBL30291156 0.92 KDM4E (0.59) KDM4EMEN1LMNAMPOMAPT
SCHEMBL16565972 0.92 KDM4E (0.59) KDM4EMEN1LMNAMPOMAPT
SCHEMBL5970454 0.92 KDM4E (0.62) KDM4EMEN1LMNAMPOMAPT
SCHEMBL31273729 0.91 ECE1 (0.62) KDM4EMEN1LMNAMPOMAPT
SCHEMBL30799518 0.91 GHSR (0.63) GHSR
SCHEMBL30799936 0.91 UTS2R (0.57) ECE1GHSRACENPY1RNPY2R
SCHEMBL5558360 0.90 ECE1 (0.69) KDM4EMEN1LMNAMPOMAPT
SCHEMBL30291268 0.90 ECE1 (0.69) KDM4EMEN1LMNAMPOMAPT
SCHEMBL30799368 0.89 GHSR (0.56) ECE1GHSRACENPY1RNPY2R

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-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF PARABILIS MEDICINES, INC. 2024-04-11 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 (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-20240116985-A1 STAPLED PEPTIDES AND METHODS THEREOF CTNNB1, APC, CTNNA1 KDM4E 2879/4885MEN1 1041/4885LMNA 830/4885

“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.