SCHEMBL20969181

SCHEMBL20969181

C[C@@H](C(=O)N1CCC(O)(c2ccccc2)CC1)[C@H]1NC(=O)[C@@H]1CO

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 8/20 0.42
OPRL1 P41146 5/20 0.41
OPRM1 P35372 4/20 0.41
OPRK1 P41145 4/20 0.41
OPRD1 P41143 3/20 0.41
ALDH1A1 P00352 2/20 0.40
ACE2 Q9BYF1 1/20 0.39
HSD11B1 P28845 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL19521183 0.92 CCR1 (0.41) CCR1OPRL1OPRM1OPRK1OPRD1
SCHEMBL19541329 0.83 CCR1 (0.44) CCR1OPRL1OPRM1OPRK1OPRD1
SCHEMBL19521260 0.83 CCR1 (0.44) CCR1OPRL1OPRM1OPRK1OPRD1
SCHEMBL19521259 0.83 CCR1 (0.44) CCR1OPRL1OPRM1OPRK1OPRD1
SCHEMBL19521261 0.83 CCR1 (0.44) CCR1OPRL1OPRM1OPRK1OPRD1
SCHEMBL20969153 0.80 ADAMTS5 (0.50) CCR1
SCHEMBL20969263 0.76 ALDH1A1 (0.46) ALDH1A1MEN1KMT2A
SCHEMBL20168992 0.75 MMP2 (0.32)
SCHEMBL12702339 0.74 OPRK1 (0.56) CCR1OPRL1OPRM1OPRK1OPRD1
SCHEMBL20169007 0.74 CHRM1 (0.38) ALDH1A1HSD11B1MEN1KMT2A

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 CCR1 3301/4885OPRL1 240/4885OPRM1 156/4885
US-20190127323-A1 Novel Beta Lactams as Modulators of Glutamate Uptake and Methods for Use Thereof SLC1A2, SLC1A1, SLC7A11 CCR1 4161/4885OPRL1 206/4885OPRM1 153/4885

“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.