SCHEMBL20969263

SCHEMBL20969263

CC1CCN(C(=O)[C@H](C)[C@H]2NC(=O)[C@@H]2CO)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
HPGD P15428 3/20 0.39
GAA P10253 1/20 0.38
NPC1 O15118 2/20 0.37
LIPE Q05469 2/20 0.37
POLB P06746 2/20 0.36
RAB9A P51151 1/20 0.35
ACHE P22303 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 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
SCHEMBL19521178 0.89 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1HPGDGAA
SCHEMBL20168992 0.85 MMP2 (0.32)
SCHEMBL20169007 0.84 CHRM1 (0.38) ALDH1A1KMT2AMEN1GAANPC1
SCHEMBL20969153 0.83 ADAMTS5 (0.50) LIPE
SCHEMBL20969156 0.82 CHRM3 (0.40) KMT2AMEN1NPC1POLBHSD17B10
SCHEMBL19521218 0.81 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1HPGDGAA
SCHEMBL19521216 0.81 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1HPGDGAA
SCHEMBL19521243 0.81 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1HPGDGAA
SCHEMBL19541656 0.81 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1HPGDGAA
SCHEMBL19521194 0.77 L3MBTL3 (0.38) ALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759750-B2 Beta lactams as modulators of glutamate uptake and methods for use thereof Temple University—Of the Commonwealth System of Higher Education (US) 2020-09-01 US disclosed
US-20190127323-A1 Novel Beta Lactams as Modulators of Glutamate Uptake and Methods for Use Thereof Temple University--of the Commonwealth System of Higher Education 2019-05-02 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 (2 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-10759750-B2 Beta lactams as modulators of glutamate uptake and methods for use thereof SLC1A2, SLC1A1, SLC7A11 ALDH1A1 885/4885KMT2A 2772/4885MEN1 4431/4885
US-20190127323-A1 Novel Beta Lactams as Modulators of Glutamate Uptake and Methods for Use Thereof SLC1A2, SLC1A1, SLC7A11 ALDH1A1 1035/4885KMT2A 3108/4885MEN1 4499/4885

“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.