SCHEMBL17019704

SCHEMBL17019704

CC(=O)[C@@H](NC(=O)Oc1ccccc1)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.58
CCR1 P32246 1/20 0.53
ALDH1A1 P00352 4/20 0.49
MAPT P10636 2/20 0.49
GAA P10253 2/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP1A2 P05177 2/20 0.47
ELANE P08246 3/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
MTNR1A P48039 3/20 0.44
MTNR1B P49286 3/20 0.44
FAAH O00519 1/20 0.44
HSP90AA1 P07900 1/20 0.44

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
SCHEMBL1951462 0.88 SLC1A3 (0.69) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL1953003 0.88 SLC1A3 (0.69) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL3363885 0.88 SLC1A3 (0.69) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL7529238 0.87 SLC1A3 (0.67) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL9421783 0.85 SLC1A3 (0.56) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL15586449 0.85 SLC1A3 (0.56) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL7529242 0.84 SLC1A3 (0.55) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL16580217 0.83 SLC1A3 (0.54) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL23240006 0.81 SLC1A3 (0.54) SLC1A3CCR1ALDH1A1MAPTGAA
SCHEMBL1895598 0.80 SLC1A3 (0.57) SLC1A3ALDH1A1MAPTGAAMEN1

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-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-08-20 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-20150232509-A1 SPIRO RING COMPOUNDS AS HEPATITIS C VIRUS (HCV) INHIBITORS HAVCR2, SLC10A1, SORD SLC1A3 3256/4885CCR1 564/4885ALDH1A1 588/4885

“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.