SCHEMBL25659999

SCHEMBL25659999

CCOC(=O)NCCN1CCNCC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
HSD17B10 Q99714 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
HTR4 Q13639 3/20 0.43
ALDH1A1 P00352 1/20 0.43
ANPEP P15144 1/20 0.43
ERAP2 Q6P179 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
ACHE P22303 3/20 0.41
RAD52 P43351 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM3 P20309 1/20 0.39
CYP3A4 P08684 1/20 0.39
GLA P06280 1/20 0.39

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
SCHEMBL11627618 0.90 ACHE (0.46) MEN1KMT2AL3MBTL1KDM4EALDH1A1
SCHEMBL8170280 0.86 MEN1 (0.57) MEN1KMT2AHSD17B10ALDH1A1ACHE
SCHEMBL22281737 0.85 ALDH1A1 (0.53) MEN1KMT2AHSD17B10L3MBTL1KDM4E
SCHEMBL22890934 0.85 HDAC2 (0.48) MEN1KMT2AL3MBTL1ALDH1A1ACHE
SCHEMBL2759481 0.82 TDP1 (0.57) ALDH1A1CYP3A4
SCHEMBL513795 0.81 MEN1 (0.55) MEN1KMT2AHSD17B10ALDH1A1ANPEP
SCHEMBL165764 0.80 HSD17B10 (0.61) MEN1KMT2AHSD17B10L3MBTL1KDM4E
SCHEMBL31301221 0.80 DRD2 (0.55) MEN1KMT2AHSD17B10ALDH1A1ANPEP
SCHEMBL11455501 0.80 KMT2A (0.47) MEN1KMT2AHSD17B10L3MBTL1KDM4E
SCHEMBL8572773 0.79 MEN1 (0.56) MEN1KMT2AHSD17B10L3MBTL1KDM4E

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-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 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-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS MEN1 492/4885KMT2A 3145/4885HSD17B10 4794/4885

“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.