SCHEMBL7130715

SCHEMBL7130715

CSc1ccc([C@@H](CC2CCC3(CC2)OCCO3)C(=O)N(C)C[C@H](CO)c2ccccc2)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TACR2 P21452 12/20 0.36
C5AR1 P21730 4/20 0.35
GPR119 Q8TDV5 1/20 0.32
TACR1 P25103 2/20 0.32

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
SCHEMBL2642049 0.87 GAA (0.35) ALDH1A1TSHRL3MBTL1TACR2C5AR1
SCHEMBL2642053 0.87 GAA (0.35) ALDH1A1TSHRL3MBTL1TACR2C5AR1
SCHEMBL7130718 0.85 ALDH1A1 (0.33) ALDH1A1TSHRL3MBTL1TACR2C5AR1
SCHEMBL2642542 0.79 SLC6A3 (0.37) ALDH1A1C5AR1GPR119
SCHEMBL1858505 0.75 GAA (0.39) ALDH1A1
SCHEMBL1858509 0.75 GAA (0.39) ALDH1A1
SCHEMBL2644230 0.75 GAA (0.39)
SCHEMBL2644229 0.75 GAA (0.39)
SCHEMBL1858506 0.75 GAA (0.39) ALDH1A1
SCHEMBL2642020 0.75 NPY5R (0.34) TACR2

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-20030225283-A1 Substituted-cycloalkyl and oxygenated-cycloalkyl glucokinase activators CORBETT WENDY LEA (US) 2003-12-04 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-20030225283-A1 Substituted-cycloalkyl and oxygenated-cycloalkyl glucokinase activators GCKR, GCK, PDXK ALDH1A1 3003/4885TSHR 2604/4885L3MBTL1 4501/4885

“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.