SCHEMBL1709298

SCHEMBL1709298

CCC(=O)[C@@H](CC)COCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 1/20 0.54
CA1 P00915 4/20 0.46
CA2 P00918 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
MMP2 P08253 1/20 0.44
MMP12 P39900 1/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 1/20 0.43
FOLH1 Q04609 1/20 0.42
CYP1A2 P05177 1/20 0.42
TACR1 P25103 2/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL1709343 1.00 SLC1A1 (0.54) SLC1A1CA1CA2CA7CA9
SCHEMBL16000772 0.87 SLC1A1 (0.65) SLC1A1CA1CA2CA7CA9
SCHEMBL12476475 0.84 SLC1A1 (0.57) SLC1A1CA1CA2CA7CA9
SCHEMBL26197467 0.82 SLC1A1 (0.48) SLC1A1CA1CA2CA7CA9
SCHEMBL8839263 0.79 SLC1A1 (0.73) SLC1A1CA1CA2CA7CA9
SCHEMBL20279723 0.79 SLC1A1 (0.43) SLC1A1CA1CA2CA7CA9
SCHEMBL1709304 0.78 CA1 (0.46) SLC1A1CA1CA2CA7CA9
SCHEMBL1709283 0.78 CYP1A2 (0.64) SLC1A1FOLH1CYP1A2
SCHEMBL1709339 0.78 CYP1A2 (0.64) SLC1A1FOLH1CYP1A2
SCHEMBL5941631 0.77 SLC1A1 (0.61) SLC1A1CA1CA2CA7CA9

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-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2012-04-12 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-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PLOD3, COL1A1, THPO SLC1A1 4477/4885CA1 3499/4885CA2 4015/4885

“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.