SCHEMBL19425992

SCHEMBL19425992

CC(C)NC(=O)C(=O)c1cc(=O)c(O)cn1O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 1/20 0.36
ALOX5 P09917 1/20 0.33
POLB P06746 1/20 0.32
CYP2C19 P33261 1/20 0.32
BCHE P06276 1/20 0.32
TYR P14679 2/20 0.32
COMT P21964 2/20 0.31

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
SCHEMBL19425993 0.88 MAPT (0.34) ALDH1A1SMN1; SMN2MAPTALOX5BCHE
SCHEMBL17191827 0.84 MAPT (0.47) ALDH1A1MAPTALOX5BCHETYR
SCHEMBL15680165 0.82 TYR (0.33) ALDH1A1TYRCOMT
SCHEMBL15680468 0.78 TYR (0.37) MAPTBCHETYRCOMT
SCHEMBL20125111 0.75 FFAR1 (0.41) ALDH1A1SMN1; SMN2MAPTTYRCOMT
SCHEMBL20626001 0.75 MAPT (0.33) ALDH1A1SMN1; SMN2MAPTPOLBCYP2C19
SCHEMBL15680168 0.73 TYR (0.32) TYR
SCHEMBL12968429 0.72 TYR (0.38) TYRCOMT
SCHEMBL15680210 0.71 TYR (0.35) TYRCOMT
SCHEMBL9664988 0.70 COMT (0.40) TYRCOMT

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-10174053-B2 2 substituted cephem compounds GLAXO GROUP LIMITED (GB) 2019-01-08 US disclosed
US-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 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-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS CEP170, CES2, CMBL ALDH1A1 1437/4885SMN1; SMN2 4325/4885MAPT 1744/4885
US-10174053-B2 2 substituted cephem compounds CEP170, CES2, CMBL ALDH1A1 1437/4885SMN1; SMN2 4325/4885MAPT 1744/4885

“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.